1-(4-nitrophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Openeye Name: 1-(4-nitrophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea CAS Name: 1-(4-nitrophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea IUPAC Name: 1-(4-nitrophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Traditional Name: 1-(4-nitrophenyl)-3-(4-sulfamoylbenzyl)thiourea Formula: C14H14N4O4S2 MolecularWeight: 366.41536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C14H14N4O4S2/c15-24(21,22)13-7-1-10(2-8-13)9-16-14(23)17-11-3-5-12(6-4-11)18(19)20/h1-8H,9H2,(H2,15,21,22)(H2,16,17,23)