(E)-N-(3-chloranyl-4-methoxy-phenyl)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enamide

Systemtic Name: (E)-N-(3-chloranyl-4-methoxy-phenyl)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enamide Openeye Name: (E)-N-(3-chloro-4-methoxy-phenyl)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enamide CAS Name: (E)-N-(3-chloro-4-methoxyphenyl)-2-cyano-3-[4-(methylthio)phenyl]-2-propenamide IUPAC Name: (E)-N-(3-chloro-4-methoxyphenyl)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enamide Traditional Name: (E)-N-(3-chloro-4-methoxy-phenyl)-2-cyano-3-[4-(methylthio)phenyl]acrylamide Formula: C18H15ClN2O2S MolecularWeight: 358.8419

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)SC)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C(=C/C2=CC=C(C=C2)SC)/C#N)Cl

InChI

InChI=1S/C18H15ClN2O2S/c1-23-17-8-5-14(10-16(17)19)21-18(22)13(11-20)9-12-3-6-15(24-2)7-4-12/h3-10H,1-2H3,(H,21,22)/b13-9+