methyl (Z)-2-cyano-3-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]prop-2-enoate

Systemtic Name: methyl (Z)-2-cyano-3-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]prop-2-enoate Openeye Name: methyl (Z)-2-cyano-3-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]prop-2-enoate CAS Name: (Z)-2-cyano-3-[5-[[(4-fluorophenyl)thio]methyl]-2,4-dimethylphenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-3-[5-[(4-fluorophenyl)sulfanylmethyl]-2,4-dimethylphenyl]prop-2-enoate Traditional Name: (Z)-2-cyano-3-[5-[[(4-fluorophenyl)thio]methyl]-2,4-dimethyl-phenyl]acrylic acid methyl ester Formula: C20H18FNO2S MolecularWeight: 355.425823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=C(C#N)C(=O)OC)CSC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=CC(=C(C=C1/C=C(/C#N)\C(=O)OC)CSC2=CC=C(C=C2)F)C

InChI

InChI=1S/C20H18FNO2S/c1-13-8-14(2)17(12-25-19-6-4-18(21)5-7-19)10-15(13)9-16(11-22)20(23)24-3/h4-10H,12H2,1-3H3/b16-9-