2-[[(4R)-5-cyano-3-ethanoyl-2-methyl-4-phenyl-3,4-dihydropyridin-6-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[(4R)-5-cyano-3-ethanoyl-2-methyl-4-phenyl-3,4-dihydropyridin-6-yl]sulfanyl]ethanamide Openeye Name: 2-[[(4R)-3-acetyl-5-cyano-2-methyl-4-phenyl-3,4-dihydropyridin-6-yl]sulfanyl]acetamide CAS Name: 2-[[(4R)-3-acetyl-5-cyano-2-methyl-4-phenyl-3,4-dihydropyridin-6-yl]thio]acetamide IUPAC Name: 2-[[(4R)-3-acetyl-5-cyano-2-methyl-4-phenyl-3,4-dihydropyridin-6-yl]sulfanyl]acetamide Traditional Name: 2-[[(4R)-3-acetyl-5-cyano-2-methyl-4-phenyl-3,4-dihydropyridin-6-yl]thio]acetamide Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O2S/c1-10-15(11(2)21)16(12-6-4-3-5-7-12)13(8-18)17(20-10)23-9-14(19)22/h3-7,15-16H,9H2,1-2H3,(H2,19,22)/t15?,16-/m1/s1