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

Systemtic Name: (3S)-4,4-dimethyl-6-[(1R)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: (3S)-4,4-dimethyl-6-[(1R)-2-morpholino-2-oxo-1-phenyl-ethyl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: (3S)-4,4-dimethyl-6-[[(1R)-2-(4-morpholinyl)-2-oxo-1-phenylethyl]thio]-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (3S)-4,4-dimethyl-6-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: (3S)-2-keto-6-[[(1R)-2-keto-2-morpholino-1-phenyl-ethyl]thio]-4,4-dimethyl-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C21H22N4O3S MolecularWeight: 410.48938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)NC(=C1C#N)SC(C2=CC=CC=C2)C(=O)N3CCOCC3)C#N)C

Isomeric SMILES

CC1([C@H](C(=O)NC(=C1C#N)S[C@H](C2=CC=CC=C2)C(=O)N3CCOCC3)C#N)C

InChI

InChI=1S/C21H22N4O3S/c1-21(2)15(12-22)18(26)24-19(16(21)13-23)29-17(14-6-4-3-5-7-14)20(27)25-8-10-28-11-9-25/h3-7,15,17H,8-11H2,1-2H3,(H,24,26)/t15-,17+/m0/s1