(2S)-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-(furan-2-ylmethyl)propanamide

Systemtic Name: (2S)-2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-(furan-2-ylmethyl)propanamide Openeye Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(2-furylmethyl)propanamide CAS Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-(2-furanylmethyl)propanamide IUPAC Name: (2S)-2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(furan-2-ylmethyl)propanamide Traditional Name: (2S)-2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-(2-furfuryl)propionamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SC(C)C(=O)NCC2=CC=CO2)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)S[C@@H](C)C(=O)NCC2=CC=CO2)C#N)C(=O)C

InChI

InChI=1S/C17H17N3O3S/c1-10-15(11(2)21)7-13(8-18)17(20-10)24-12(3)16(22)19-9-14-5-4-6-23-14/h4-7,12H,9H2,1-3H3,(H,19,22)/t12-/m0/s1