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

Systemtic Name: (3S)-4,4-dimethyl-6-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: (3S)-4,4-dimethyl-6-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: (3S)-4,4-dimethyl-6-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (3S)-4,4-dimethyl-6-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: (3S)-2-keto-6-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-4,4-dimethyl-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=C(C(C(C(=O)N3)C#N)(C)C)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=C(C([C@H](C(=O)N3)C#N)(C)C)C#N

InChI

InChI=1S/C20H18N4O2S/c1-11-17(12-6-4-5-7-15(12)23-11)16(25)10-27-19-14(9-22)20(2,3)13(8-21)18(26)24-19/h4-7,13,23H,10H2,1-3H3,(H,24,26)/t13-/m0/s1