1-(2-methoxy-4-nitro-phenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-(4-sulfamoylbenzyl)thiourea Formula: C15H16N4O5S2 MolecularWeight: 396.44134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C15H16N4O5S2/c1-24-14-8-11(19(20)21)4-7-13(14)18-15(25)17-9-10-2-5-12(6-3-10)26(16,22)23/h2-8H,9H2,1H3,(H2,16,22,23)(H2,17,18,25)