propan-2-yl 2-[3-cyano-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[3-cyano-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[[3-cyano-6-methyl-5-(phenylcarbamoyl)-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[5-[anilino(oxo)methyl]-3-cyano-6-methyl-2-pyridinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[3-cyano-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyano-6-methyl-5-(phenylcarbamoyl)-2-pyridyl]thio]acetic acid isopropyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)OC(C)C)C#N)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)OC(C)C)C#N)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H19N3O3S/c1-12(2)25-17(23)11-26-19-14(10-20)9-16(13(3)21-19)18(24)22-15-7-5-4-6-8-15/h4-9,12H,11H2,1-3H3,(H,22,24)