N-(4-methylsulfanylphenyl)-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide

Systemtic Name: N-(4-methylsulfanylphenyl)-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide Openeye Name: N-(4-methylsulfanylphenyl)-3-(2-nitro-4-sulfamoyl-anilino)propanamide CAS Name: N-[4-(methylthio)phenyl]-3-(2-nitro-4-sulfamoylanilino)propanamide IUPAC Name: N-(4-methylsulfanylphenyl)-3-(2-nitro-4-sulfamoylanilino)propanamide Traditional Name: N-[4-(methylthio)phenyl]-3-(2-nitro-4-sulfamoyl-anilino)propionamide Formula: C16H18N4O5S2 MolecularWeight: 410.46792

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O5S2/c1-26-12-4-2-11(3-5-12)19-16(21)8-9-18-14-7-6-13(27(17,24)25)10-15(14)20(22)23/h2-7,10,18H,8-9H2,1H3,(H,19,21)(H2,17,24,25)