1-(3,4-dimethylphenyl)-3-[[4-(phenylsulfonylamino)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[[4-(phenylsulfonylamino)phenyl]carbonylamino]thiourea Openeye Name: 1-[[4-(benzenesulfonamido)benzoyl]amino]-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-[[[4-(benzenesulfonamido)phenyl]-oxomethyl]amino]-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-[[4-(benzenesulfonamido)benzoyl]amino]-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-[[4-(benzenesulfonamido)benzoyl]amino]-3-(3,4-dimethylphenyl)thiourea Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H22N4O3S2/c1-15-8-11-19(14-16(15)2)23-22(30)25-24-21(27)17-9-12-18(13-10-17)26-31(28,29)20-6-4-3-5-7-20/h3-14,26H,1-2H3,(H,24,27)(H2,23,25,30)