(2S)-N-(2-ethyl-6-methyl-phenyl)-2-pyridin-3-yl-piperidine-1-carbothioamide

Systemtic Name: (2S)-N-(2-ethyl-6-methyl-phenyl)-2-pyridin-3-yl-piperidine-1-carbothioamide Openeye Name: (2S)-N-(2-ethyl-6-methyl-phenyl)-2-(3-pyridyl)piperidine-1-carbothioamide CAS Name: (2S)-N-(2-ethyl-6-methylphenyl)-2-(3-pyridinyl)-1-piperidinecarbothioamide IUPAC Name: (2S)-N-(2-ethyl-6-methylphenyl)-2-pyridin-3-ylpiperidine-1-carbothioamide Traditional Name: (2S)-N-(2-ethyl-6-methyl-phenyl)-2-(3-pyridyl)piperidine-1-carbothioamide Formula: C20H25N3S MolecularWeight: 339.4976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)N2CCCCC2C3=CN=CC=C3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N2CCCC[C@H]2C3=CN=CC=C3)C

InChI

InChI=1S/C20H25N3S/c1-3-16-9-6-8-15(2)19(16)22-20(24)23-13-5-4-11-18(23)17-10-7-12-21-14-17/h6-10,12,14,18H,3-5,11,13H2,1-2H3,(H,22,24)/t18-/m0/s1