2-[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[1-(1H-indol-3-yl)-1-oxopropan-2-yl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[1-(1H-indol-3-yl)-1-oxopropan-2-yl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC(C)C(=O)C2=CNC3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC(C)C(=O)C2=CNC3=CC=CC=C32)C

InChI

InChI=1S/C19H17N3OS/c1-11-8-12(2)22-19(15(11)9-20)24-13(3)18(23)16-10-21-17-7-5-4-6-14(16)17/h4-8,10,13,21H,1-3H3