3-(hydroxymethyl)-N-(2-methylphenyl)piperidine-1-carbothioamide

Systemtic Name: 3-(hydroxymethyl)-N-(2-methylphenyl)piperidine-1-carbothioamide Openeye Name: 3-(hydroxymethyl)-N-(o-tolyl)piperidine-1-carbothioamide CAS Name: 3-(hydroxymethyl)-N-(2-methylphenyl)-1-piperidinecarbothioamide IUPAC Name: 3-(hydroxymethyl)-N-(2-methylphenyl)piperidine-1-carbothioamide Traditional Name: 3-methylol-N-(o-tolyl)piperidine-1-carbothioamide Formula: C14H20N2OS MolecularWeight: 264.3864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCCC(C2)CO

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCCC(C2)CO

InChI

InChI=1S/C14H20N2OS/c1-11-5-2-3-7-13(11)15-14(18)16-8-4-6-12(9-16)10-17/h2-3,5,7,12,17H,4,6,8-10H2,1H3,(H,15,18)