methyl (2R)-2-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylethanoylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2R)-2-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylethanoylamino]-2-phenyl-ethanoate Openeye Name: methyl (2R)-2-[[2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]acetyl]amino]-2-phenyl-acetate CAS Name: (2R)-2-[[2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-1-oxoethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetyl]amino]-2-phenylacetate Traditional Name: (2R)-2-[[2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]acetyl]amino]-2-phenyl-acetic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NC(C2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)N[C@H](C2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C19H19N3O3S/c1-12-9-13(2)21-18(15(12)10-20)26-11-16(23)22-17(19(24)25-3)14-7-5-4-6-8-14/h4-9,17H,11H2,1-3H3,(H,22,23)/t17-/m1/s1