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1-butyl-3-(4-phenoxyphenyl)thiourea

PropertiesImage
MNX_IDMNXM344523 Image of MNXM344523
referencechebi:108123
formulaC17H20N2OS
global charge0
mol weight300.427
InChIKeyWMUMMRQASOQEKE-UHFFFAOYSA-N
InChIInChI=1S/C17H20N2OS/c1-2-3-13-18-17(21)19-14-9-11-16(12-10-14)20-15-7-5-4-6-8-15/h4-12H,2-3,13H2,1H3,(H2,18,19,21)
SMILESCCCCNC(=S)NC1=CC=C(OC2=CC=CC=C2)C=C1
MNX internals
InChI (mnx)InChI=1/C17H20N2OS/c1-2-3-13-18-17(21)19-14-9-11-16(12-10-14)20-15-7-5-4-6-8-15/h4-12H,2-3,13H2,1H3,(H2,18,19,21) Image of MNXM344523
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:13][N:18]=[C:17]([NH:19][C:14]1=[CH:10][CH:12]=[C:16]([O:20][C:15]2=[CH:7][CH:5]=[CH:4][CH:6]=[CH:8]2)[CH:11]=[CH:9]1)[SH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:108123
chebi:108123
WMUMMRQASOQEKE-UHFFFAOYSA-N
1-butyl-3-(4-phenoxyphenyl)thiourea