(2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridin-6-yl]sulfanyl]-N-naphthalen-1-yl-propanamide

Systemtic Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridin-6-yl]sulfanyl]-N-naphthalen-1-yl-propanamide Openeye Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]-N-(1-naphthyl)propanamide CAS Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]thio]-N-(1-naphthalenyl)propanamide IUPAC Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]-N-naphthalen-1-ylpropanamide Traditional Name: (2R)-2-[[(3S)-3,5-dicyano-2-keto-4,4-dimethyl-1,3-dihydropyridin-6-yl]thio]-N-(1-naphthyl)propionamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=C(C(C(C(=O)N3)C#N)(C)C)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC2=CC=CC=C21)SC3=C(C([C@H](C(=O)N3)C#N)(C)C)C#N

InChI

InChI=1S/C22H20N4O2S/c1-13(19(27)25-18-10-6-8-14-7-4-5-9-15(14)18)29-21-17(12-24)22(2,3)16(11-23)20(28)26-21/h4-10,13,16H,1-3H3,(H,25,27)(H,26,28)/t13-,16+/m1/s1