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4-hydroxytriazolam

PropertiesImage
MNX_IDMNXM151205 Image of MNXM151205
referencechebi:169925
formulaC17H12Cl2N4O
global charge0
mol weight359.216
InChIKeyYUQRFPYHTPARRM-UHFFFAOYSA-N
InChIInChI=1S/C17H12Cl2N4O/c1-9-21-22-16-17(24)20-15(11-4-2-3-5-13(11)19)12-8-10(18)6-7-14(12)23(9)16/h2-8,17,24H,1H3
SMILESCC1=NN=C2C(O)N=C(C3=C(Cl)C=CC=C3)C3=C(C=CC(Cl)=C3)N12
MNX internals
InChI (mnx)InChI=1/C17H12Cl2N4O/c1-9-21-22-16-17(24)20-15(11-4-2-3-5-13(11)19)12-8-10(18)6-7-14(12)23(9)16/h2-8,17,24H,1H3/t17? Image of MNXM151205
SMILES (mnx)[CH3:1][C:9]1=[N:21][N:22]=[C:16]2[CH:17]([OH:24])[N:20]=[C:15]([C:11]3=[CH:4][CH:2]=[CH:3][CH:5]=[C:13]3[Cl:19])[C:12]3=[C:14]([CH:7]=[CH:6][C:10]([Cl:18])=[CH:8]3)[N:23]12
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:169925
chebi:169925
YUQRFPYHTPARRM-UHFFFAOYSA-N 		4-hydroxytriazolam
8-chloro-6-(2-chlorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-ol

vmhM:4oh_trz
vmhmetabolite:4oh_trz
YUQRFPYHTPARRM-UHFFFAOYSA-N 		4-Hydroxytriazolam
12-chloro-9-(2-chlorophenyl)-3-methyl-2,4,5,8-tetraazatricyclo[8.4.0.0²,⁶]tetradeca-1(10),3,5,8,11,13-hexaen-7-ol
hmdb:HMDB0061052
YUQRFPYHTPARRM-UHFFFAOYSA-N 		4-hydroxytriazolam
12-chloro-9-(2-chlorophenyl)-3-methyl-2,4,5,8-tetraazatricyclo[8.4.0.0²,⁶]tetradeca-1(10),3,5,8,11,13-hexaen-7-ol

hmdb:HMDB61052
vmhM:M_4oh_trz 		secondary/obsolete/fantasy identifier