(E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-(4-sulfamoylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-(4-sulfamoylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-(4-sulfamoylphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(methylamino)-3-nitrophenyl]-N-(4-sulfamoylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-(methylamino)-3-nitrophenyl]-N-(4-sulfamoylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-(4-sulfamoylphenyl)acrylamide Formula: C17H15N5O5S MolecularWeight: 401.3965

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O5S/c1-20-15-7-2-11(9-16(15)22(24)25)8-12(10-18)17(23)21-13-3-5-14(6-4-13)28(19,26)27/h2-9,20H,1H3,(H,21,23)(H2,19,26,27)/b12-8+