(3S)-4,4-dimethyl-6-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: (3S)-4,4-dimethyl-6-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: (3S)-4,4-dimethyl-6-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: (3S)-4,4-dimethyl-6-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (3S)-4,4-dimethyl-6-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: (3S)-2-keto-6-[[2-keto-2-(4-methylpiperidino)ethyl]thio]-4,4-dimethyl-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=C(C(C(C(=O)N2)C#N)(C)C)C#N

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=C(C([C@H](C(=O)N2)C#N)(C)C)C#N

InChI

InChI=1S/C17H22N4O2S/c1-11-4-6-21(7-5-11)14(22)10-24-16-13(9-19)17(2,3)12(8-18)15(23)20-16/h11-12H,4-7,10H2,1-3H3,(H,20,23)/t12-/m0/s1