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

Systemtic Name: 4,4-dimethyl-6-[1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-2-oxidanylidene-1,3-dihydropyridine-3,5-dicarbonitrile Openeye Name: 4,4-dimethyl-6-[1-methyl-2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile CAS Name: 4,4-dimethyl-6-[[1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]thio]-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile IUPAC Name: 4,4-dimethyl-6-[1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]sulfanyl-2-oxo-1,3-dihydropyridine-3,5-dicarbonitrile Traditional Name: 2-keto-6-[[2-keto-1-methyl-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-4,4-dimethyl-1,3-dihydropyridine-3,5-dicarbonitrile Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=C(C(C(C(=O)N3)C#N)(C)C)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=C(C(C(C(=O)N3)C#N)(C)C)C#N

InChI

InChI=1S/C21H20N4O2S/c1-11-17(13-7-5-6-8-16(13)24-11)18(26)12(2)28-20-15(10-23)21(3,4)14(9-22)19(27)25-20/h5-8,12,14,24H,1-4H3,(H,25,27)