4,4-dimethyl-2-oxidanylidene-6-(2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: 4,4-dimethyl-2-oxidanylidene-6-(2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: 4,4-dimethyl-2-oxo-6-(2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: 4,4-dimethyl-2-oxo-6-[[2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl]thio]-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: 4,4-dimethyl-2-oxo-6-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)sulfanyl-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: 2-keto-6-[(2-keto-1-phenyl-2-pyrrolidino-ethyl)thio]-4,4-dimethyl-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)NC(=C1C#N)SC(C2=CC=CC=C2)C(=O)N3CCCC3)C#N)C

Isomeric SMILES

CC1(C(C(=O)NC(=C1C#N)SC(C2=CC=CC=C2)C(=O)N3CCCC3)C#N)C

InChI

InChI=1S/C21H22N4O2S/c1-21(2)15(12-22)18(26)24-19(16(21)13-23)28-17(14-8-4-3-5-9-14)20(27)25-10-6-7-11-25/h3-5,8-9,15,17H,6-7,10-11H2,1-2H3,(H,24,26)