4,5,6-trimethyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,5,6-trimethyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,5,6-trimethyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4,5,6-trimethyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4,5,6-trimethyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyridine-3-carbonitrile Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-4,5,6-trimethyl-nicotinonitrile Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)N2CCCCC2)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)N2CCCCC2)C

InChI

InChI=1S/C16H21N3OS/c1-11-12(2)14(9-17)16(18-13(11)3)21-10-15(20)19-7-5-4-6-8-19/h4-8,10H2,1-3H3