1-(3-nitrophenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(3-nitrophenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea Openeye Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-(3-nitrophenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(3-nitrophenyl)thiourea Formula: C20H18N4O4S2 MolecularWeight: 442.51132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S2/c25-24(26)18-8-4-7-17(13-18)23-20(29)22-16-9-11-19(12-10-16)30(27,28)21-14-15-5-2-1-3-6-15/h1-13,21H,14H2,(H2,22,23,29)