ethyl (E)-3-[3-[2-(4-chlorophenyl)sulfanylethanoyloxy]phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[2-(4-chlorophenyl)sulfanylethanoyloxy]phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-[2-(4-chlorophenyl)sulfanylacetyl]oxyphenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[2-[(4-chlorophenyl)thio]-1-oxoethoxy]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[2-(4-chlorophenyl)sulfanylacetyl]oxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[2-[(4-chlorophenyl)thio]acetyl]oxyphenyl]-2-cyano-acrylic acid ethyl ester Formula: C20H16ClNO4S MolecularWeight: 401.86334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=CC=C1)OC(=O)CSC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=CC=C1)OC(=O)CSC2=CC=C(C=C2)Cl)/C#N

InChI

InChI=1S/C20H16ClNO4S/c1-2-25-20(24)15(12-22)10-14-4-3-5-17(11-14)26-19(23)13-27-18-8-6-16(21)7-9-18/h3-11H,2,13H2,1H3/b15-10+