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

Systemtic Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[2-(2,6-dimethylpiperidino)-2-keto-ethyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=C(C(=CC(=N2)C)C)C#N)C

Isomeric SMILES

CC1CCCC(N1C(=O)CSC2=C(C(=CC(=N2)C)C)C#N)C

InChI

InChI=1S/C17H23N3OS/c1-11-8-12(2)19-17(15(11)9-18)22-10-16(21)20-13(3)6-5-7-14(20)4/h8,13-14H,5-7,10H2,1-4H3