[(3R,5S)-3,5-dimethylpiperidin-1-yl]-(2-sulfanylidenepyridin-3-ylidene)methanolate

Systemtic Name: [(3R,5S)-3,5-dimethylpiperidin-1-yl]-(2-sulfanylidenepyridin-3-ylidene)methanolate Openeye Name: [(3R,5S)-3,5-dimethyl-1-piperidyl]-(2-thioxo-3-pyridylidene)methanolate CAS Name: [(3R,5S)-3,5-dimethyl-1-piperidinyl]-(2-sulfanylidene-3-pyridinylidene)methanolate IUPAC Name: [(3R,5S)-3,5-dimethylpiperidin-1-yl]-(2-sulfanylidenepyridin-3-ylidene)methanolate Traditional Name: [(3R,5S)-3,5-dimethylpiperidino]-(2-thioxo-3-pyridylidene)methanolate Formula: C13H17N2OS- MolecularWeight: 249.35188

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=C2C=CC=NC2=S)[O-])C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)C(=C2C=CC=NC2=S)[O-])C

InChI

InChI=1S/C13H18N2OS/c1-9-6-10(2)8-15(7-9)13(16)11-4-3-5-14-12(11)17/h3-5,9-10,16H,6-8H2,1-2H3/p-1/t9-,10+