(E)-2-cyano-3-[(3-methoxyphenyl)amino]-3-[(3-nitrophenyl)methylsulfanyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[(3-methoxyphenyl)amino]-3-[(3-nitrophenyl)methylsulfanyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(3-methoxyanilino)-3-[(3-nitrophenyl)methylsulfanyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(3-methoxyanilino)-3-[(3-nitrophenyl)methylthio]-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-methoxyanilino)-3-[(3-nitrophenyl)methylsulfanyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(m-anisidino)-3-[(3-nitrobenzyl)thio]acrylamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=C(C#N)C(=O)N)SCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N/C(=C(/C#N)\C(=O)N)/SCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c1-26-15-7-3-5-13(9-15)21-18(16(10-19)17(20)23)27-11-12-4-2-6-14(8-12)22(24)25/h2-9,21H,11H2,1H3,(H2,20,23)/b18-16+