MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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methimazole

	Properties	Image
MNX_ID	MNXM3302
reference	chebi:50673
formula	C₄H₆N₂S
global charge	0
mol weight	114.173
InChIKey	PMRYVIKBURPHAH-UHFFFAOYSA-N
InChI	InChI=1S/C4H6N2S/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)
SMILES	CN1C=CNC1=S

MNX internals

InChI (mnx)	InChI=1/C4H6N2S/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)
SMILES (mnx)	[CH3:1][N:6]1[CH:3]=[CH:2][N:5]=[C:4]1[SH:7]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-217315 reactomeM:R-ALL-217315 reactome:R-ALL-9728946 reactomeM:R-ALL-9728946 CHEBI:50673 chebi:50673 PMRYVIKBURPHAH-UHFFFAOYSA-N	methimazole 1-METHYL-1,3-DIHYDRO-2H-IMIDAZOLE-2-THIONE 1-Methylimidazole-2(3H)-thione 1-methyl-1,3-dihydro-2H-imidazole-2-thione Danantizol Favistan Methimazole Strumazol Tapazole Thacapzol USAF el-30 thiamazol thiamazole thiamazolum tiamazol
kegg.drug:D00401 keggD:D00401 PMRYVIKBURPHAH-UHFFFAOYSA-N	Methimazole (USP) Tapazole (TN) Thiamazole (JP18/INN)
hmdb:HMDB0014901 PMRYVIKBURPHAH-UHFFFAOYSA-N	Methimazole 1 Methyl 2 mercaptoimidazole 1-METHYL-1,3-dihydro-2H-imidazole-2-thione 1-Methyl-2-mercaptoimidazole 1-Methylimidazole-2(3H)-thione 1-methyl-2,3-dihydro-1H-imidazole-2-thione Danantizol Eli lilly brand OF methimazole Estedi brand OF methimazole Favistan Henning berlin brand OF methimazole Henning, thiamazol Hexal brand OF methimazole Hexal, thiamazol Jones brand OF methimazole Mercaptazole Mercasolyl Mercazol Mercazole Mercazolyl Merck brand OF methimazole Merkazolil Metazolo Methamazole Methiamazole Methimazol Methizol Methylmercaptoimidazole Methymazol Metisol Metizol Metothyrin Metothyrine Nourypharma brand OF methimazole Philopharm brand OF methimazole Sanofi synthelabo brand OF methimazole Strumazol Tapazole Temmler brand OF methimazole Thacapzol Thiamazol Thiamazol henning Thiamazol hexal Thiamazole Thiamazolum Thimazol Thimazole Thymidazol Thymidazole Thyrozol Tiamazol Tirodril USAF el-30 methimazole
sabiork.compound:9305 sabiorkM:9305 PMRYVIKBURPHAH-UHFFFAOYSA-N	Methimazole 2-Mercapto-1-methylimidazole 2-Thio-1-methylimidazole Thiamazole
seed.compound:cpd19073 seedM:cpd19073 PMRYVIKBURPHAH-UHFFFAOYSA-N	Thiamazole 1-methyl-2-mercaptoimidazole 1-methylimidazole-2-thiol Methimazole methimazole
kegg.compound:C07190 keggC:C07190 PMRYVIKBURPHAH-UHFFFAOYSA-N	Thiamazole Methimazole
metacyc.compound:CPD-11282 metacycM:CPD-11282 PMRYVIKBURPHAH-UHFFFAOYSA-N	methimazole 1-methyl-2-mercaptoimidazole 1-methylimidazole-2-thiol
hmdb:HMDB14901 chebi:44168 chebi:6828 keggC:M_C07190 keggD:M_D00401 seedM:M_cpd19073	secondary/obsolete/fantasy identifier