(2R)-2-[4-(4-chlorophenyl)-3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanylpropanoate

Systemtic Name: (2R)-2-[4-(4-chlorophenyl)-3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanylpropanoate Openeye Name: (2R)-2-[[4-(4-chlorophenyl)-3-cyano-6-(p-tolyl)-2-pyridyl]sulfanyl]propanoate CAS Name: (2R)-2-[[4-(4-chlorophenyl)-3-cyano-6-(4-methylphenyl)-2-pyridinyl]thio]propanoate IUPAC Name: (2R)-2-[4-(4-chlorophenyl)-3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[4-(4-chlorophenyl)-3-cyano-6-(p-tolyl)-2-pyridyl]thio]propionate Formula: C22H16ClN2O2S- MolecularWeight: 407.89264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)Cl)C#N)SC(C)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)Cl)C#N)S[C@H](C)C(=O)[O-]

InChI

InChI=1S/C22H17ClN2O2S/c1-13-3-5-16(6-4-13)20-11-18(15-7-9-17(23)10-8-15)19(12-24)21(25-20)28-14(2)22(26)27/h3-11,14H,1-2H3,(H,26,27)/p-1/t14-/m1/s1