N,N-dimethyl-3-[(2-nitro-4-sulfamoyl-phenyl)amino]-4-phenylsulfanyl-butanamide

Systemtic Name: N,N-dimethyl-3-[(2-nitro-4-sulfamoyl-phenyl)amino]-4-phenylsulfanyl-butanamide Openeye Name: N,N-dimethyl-3-(2-nitro-4-sulfamoyl-anilino)-4-phenylsulfanyl-butanamide CAS Name: N,N-dimethyl-3-(2-nitro-4-sulfamoylanilino)-4-(phenylthio)butanamide IUPAC Name: N,N-dimethyl-3-(2-nitro-4-sulfamoylanilino)-4-phenylsulfanylbutanamide Traditional Name: N,N-dimethyl-3-(2-nitro-4-sulfamoyl-anilino)-4-(phenylthio)butyramide Formula: C18H22N4O5S2 MolecularWeight: 438.52108

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CC(CSC1=CC=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CC(CSC1=CC=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S2/c1-21(2)18(23)10-13(12-28-14-6-4-3-5-7-14)20-16-9-8-15(29(19,26)27)11-17(16)22(24)25/h3-9,11,13,20H,10,12H2,1-2H3,(H2,19,26,27)