1-(2-methylcyclohexyl)-3-[[4-(phenylsulfamoyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(2-methylcyclohexyl)-3-[[4-(phenylsulfamoyl)phenyl]carbonylamino]thiourea Openeye Name: 1-(2-methylcyclohexyl)-3-[[4-(phenylsulfamoyl)benzoyl]amino]thiourea CAS Name: 1-(2-methylcyclohexyl)-3-[[oxo-[4-(phenylsulfamoyl)phenyl]methyl]amino]thiourea IUPAC Name: 1-(2-methylcyclohexyl)-3-[[4-(phenylsulfamoyl)benzoyl]amino]thiourea Traditional Name: 1-(2-methylcyclohexyl)-3-[[4-(phenylsulfamoyl)benzoyl]amino]thiourea Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1CCCCC1NC(=S)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3S2/c1-15-7-5-6-10-19(15)22-21(29)24-23-20(26)16-11-13-18(14-12-16)30(27,28)25-17-8-3-2-4-9-17/h2-4,8-9,11-15,19,25H,5-7,10H2,1H3,(H,23,26)(H2,22,24,29)