methyl 2-[3-[2-(3-cyanopropylsulfinyl)phenyl]-5-phenyl-4-sulfanylidene-pyridin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[2-(3-cyanopropylsulfinyl)phenyl]-5-phenyl-4-sulfanylidene-pyridin-1-yl]ethanoate Openeye Name: methyl 2-[3-[2-(3-cyanopropylsulfinyl)phenyl]-5-phenyl-4-thioxo-1-pyridyl]acetate CAS Name: 2-[3-[2-(3-cyanopropylsulfinyl)phenyl]-5-phenyl-4-sulfanylidene-1-pyridinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-(3-cyanopropylsulfinyl)phenyl]-5-phenyl-4-sulfanylidenepyridin-1-yl]acetate Traditional Name: 2-[3-[2-(3-cyanopropylsulfinyl)phenyl]-5-phenyl-4-thioxo-1-pyridyl]acetic acid methyl ester Formula: C24H22N2O3S2 MolecularWeight: 450.57308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=C(C(=S)C(=C1)C2=CC=CC=C2S(=O)CCCC#N)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CN1C=C(C(=S)C(=C1)C2=CC=CC=C2S(=O)CCCC#N)C3=CC=CC=C3

InChI

InChI=1S/C24H22N2O3S2/c1-29-23(27)17-26-15-20(18-9-3-2-4-10-18)24(30)21(16-26)19-11-5-6-12-22(19)31(28)14-8-7-13-25/h2-6,9-12,15-16H,7-8,14,17H2,1H3