(2R)-N-(2,6-diethylphenyl)-2-pyridin-3-yl-piperidine-1-carbothioamide

Systemtic Name: (2R)-N-(2,6-diethylphenyl)-2-pyridin-3-yl-piperidine-1-carbothioamide Openeye Name: (2R)-N-(2,6-diethylphenyl)-2-(3-pyridyl)piperidine-1-carbothioamide CAS Name: (2R)-N-(2,6-diethylphenyl)-2-(3-pyridinyl)-1-piperidinecarbothioamide IUPAC Name: (2R)-N-(2,6-diethylphenyl)-2-pyridin-3-ylpiperidine-1-carbothioamide Traditional Name: (2R)-N-(2,6-diethylphenyl)-2-(3-pyridyl)piperidine-1-carbothioamide Formula: C21H27N3S MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCCCC2C3=CN=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCCC[C@@H]2C3=CN=CC=C3

InChI

InChI=1S/C21H27N3S/c1-3-16-9-7-10-17(4-2)20(16)23-21(25)24-14-6-5-12-19(24)18-11-8-13-22-15-18/h7-11,13,15,19H,3-6,12,14H2,1-2H3,(H,23,25)/t19-/m1/s1