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

Systemtic Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridin-6-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]-N-phenyl-propanamide CAS Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]thio]-N-phenylpropanamide IUPAC Name: (2R)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]-N-phenylpropanamide Traditional Name: (2R)-2-[[(3S)-3,5-dicyano-2-keto-4,4-dimethyl-1,3-dihydropyridin-6-yl]thio]-N-phenyl-propionamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=C(C(C(C(=O)N2)C#N)(C)C)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)SC2=C(C([C@H](C(=O)N2)C#N)(C)C)C#N

InChI

InChI=1S/C18H18N4O2S/c1-11(15(23)21-12-7-5-4-6-8-12)25-17-14(10-20)18(2,3)13(9-19)16(24)22-17/h4-8,11,13H,1-3H3,(H,21,23)(H,22,24)/t11-,13+/m1/s1