(E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methoxy-5-methyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methoxy-5-methyl-phenyl)prop-2-enamide Openeye Name: (E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methoxy-5-methyl-phenyl)prop-2-enamide CAS Name: (E)-N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-(2-methoxy-5-methylphenyl)-2-propenamide IUPAC Name: (E)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(2-methoxy-5-methylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-[(2-cyanobenzyl)thio]ethyl]-3-(2-methoxy-5-methyl-phenyl)acrylamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C21H22N2O2S/c1-16-7-9-20(25-2)17(13-16)8-10-21(24)23-11-12-26-15-19-6-4-3-5-18(19)14-22/h3-10,13H,11-12,15H2,1-2H3,(H,23,24)/b10-8+