2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carbonitrile

Systemtic Name: 2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carbonitrile Openeye Name: 2-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]sulfanylpyridine-3-carbonitrile CAS Name: 2-[[2-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-oxoethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-ethyl]thio]nicotinonitrile Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CSC2=C(C=CC=N2)C#N)C

InChI

InChI=1S/C15H19N3OS/c1-11-5-3-6-12(2)18(11)14(19)10-20-15-13(9-16)7-4-8-17-15/h4,7-8,11-12H,3,5-6,10H2,1-2H3/t11-,12-/m1/s1