(3S)-4,4-dimethyl-2-oxidanylidene-6-(quinolin-8-ylmethylsulfanyl)-1,3-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: (3S)-4,4-dimethyl-2-oxidanylidene-6-(quinolin-8-ylmethylsulfanyl)-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: (3S)-4,4-dimethyl-2-oxo-6-(8-quinolylmethylsulfanyl)-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: (3S)-4,4-dimethyl-2-oxo-6-(8-quinolinylmethylthio)-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (3S)-4,4-dimethyl-2-oxo-6-(quinolin-8-ylmethylsulfanyl)-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: (3S)-2-keto-4,4-dimethyl-6-(8-quinolylmethylthio)-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)NC(=C1C#N)SCC2=CC=CC3=C2N=CC=C3)C#N)C

Isomeric SMILES

CC1([C@H](C(=O)NC(=C1C#N)SCC2=CC=CC3=C2N=CC=C3)C#N)C

InChI

InChI=1S/C19H16N4OS/c1-19(2)14(9-20)17(24)23-18(15(19)10-21)25-11-13-6-3-5-12-7-4-8-22-16(12)13/h3-8,14H,11H2,1-2H3,(H,23,24)/t14-/m0/s1