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

Systemtic Name: 4,6-dimethyl-2-[2-oxidanylidene-2-(4-phenethylpiperidin-1-yl)ethyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-[2-oxo-2-(4-phenethyl-1-piperidyl)ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[[2-oxo-2-(4-phenethyl-1-piperidinyl)ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-[2-oxo-2-(4-phenethylpiperidin-1-yl)ethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-(4-phenethylpiperidino)ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)N2CCC(CC2)CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)N2CCC(CC2)CCC3=CC=CC=C3)C

InChI

InChI=1S/C23H27N3OS/c1-17-14-18(2)25-23(21(17)15-24)28-16-22(27)26-12-10-20(11-13-26)9-8-19-6-4-3-5-7-19/h3-7,14,20H,8-13,16H2,1-2H3