4,6-dimethyl-2-[2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-[2-(1-methylpyrrol-2-yl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-[2-(1-methylpyrrol-2-yl)-2-oxo-ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[[2-(1-methyl-2-pyrrolyl)-2-oxoethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-[2-(1-methylpyrrol-2-yl)-2-oxoethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-(1-methylpyrrol-2-yl)ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C15H15N3OS MolecularWeight: 285.3641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)C2=CC=CN2C)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)C2=CC=CN2C)C

InChI

InChI=1S/C15H15N3OS/c1-10-7-11(2)17-15(12(10)8-16)20-9-14(19)13-5-4-6-18(13)3/h4-7H,9H2,1-3H3