1-(3-methylphenyl)-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-(3-methylphenyl)-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-(m-tolyl)-3-[4-(thiazol-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-(3-methylphenyl)-3-[4-(2-thiazolylsulfamoyl)phenyl]thiourea IUPAC Name: 1-(3-methylphenyl)-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(m-tolyl)-3-[4-(thiazol-2-ylsulfamoyl)phenyl]thiourea Formula: C17H16N4O2S3 MolecularWeight: 404.52954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C17H16N4O2S3/c1-12-3-2-4-14(11-12)20-16(24)19-13-5-7-15(8-6-13)26(22,23)21-17-18-9-10-25-17/h2-11H,1H3,(H,18,21)(H2,19,20,24)