1-(2-methoxy-4-nitro-phenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea Openeye Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C21H20N4O5S2 MolecularWeight: 472.5373

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H20N4O5S2/c1-30-20-13-17(25(26)27)9-12-19(20)24-21(31)23-16-7-10-18(11-8-16)32(28,29)22-14-15-5-3-2-4-6-15/h2-13,22H,14H2,1H3,(H2,23,24,31)