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

Systemtic Name: (2S)-N-(3-chloranyl-2-methyl-phenyl)-2-pyridin-3-yl-piperidine-1-carbothioamide Openeye Name: (2S)-N-(3-chloro-2-methyl-phenyl)-2-(3-pyridyl)piperidine-1-carbothioamide CAS Name: (2S)-N-(3-chloro-2-methylphenyl)-2-(3-pyridinyl)-1-piperidinecarbothioamide IUPAC Name: (2S)-N-(3-chloro-2-methylphenyl)-2-pyridin-3-ylpiperidine-1-carbothioamide Traditional Name: (2S)-N-(3-chloro-2-methyl-phenyl)-2-(3-pyridyl)piperidine-1-carbothioamide Formula: C18H20ClN3S MolecularWeight: 345.8895

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)N2CCCCC2C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N2CCCC[C@H]2C3=CN=CC=C3

InChI

InChI=1S/C18H20ClN3S/c1-13-15(19)7-4-8-16(13)21-18(23)22-11-3-2-9-17(22)14-6-5-10-20-12-14/h4-8,10,12,17H,2-3,9,11H2,1H3,(H,21,23)/t17-/m0/s1