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

Systemtic Name: 4,6-dimethyl-2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[[2-(3-methyl-1-piperidinyl)-2-oxoethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-(3-methylpiperidino)ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=C(C(=CC(=N2)C)C)C#N

Isomeric SMILES

CC1CCCN(C1)C(=O)CSC2=C(C(=CC(=N2)C)C)C#N

InChI

InChI=1S/C16H21N3OS/c1-11-5-4-6-19(9-11)15(20)10-21-16-14(8-17)12(2)7-13(3)18-16/h7,11H,4-6,9-10H2,1-3H3