(E)-2-cyano-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-methoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-methoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-(3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-[2-[(2-cyanobenzyl)thio]ethyl]-3-(3-methoxyphenyl)acrylamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C#N)C(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

COC1=CC=CC(=C1)/C=C(\C#N)/C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C21H19N3O2S/c1-26-20-8-4-5-16(12-20)11-19(14-23)21(25)24-9-10-27-15-18-7-3-2-6-17(18)13-22/h2-8,11-12H,9-10,15H2,1H3,(H,24,25)/b19-11+