(3S)-3-(hydroxymethyl)-N-[2-(4-methoxyphenyl)ethyl]piperidine-1-carbothioamide

Systemtic Name: (3S)-3-(hydroxymethyl)-N-[2-(4-methoxyphenyl)ethyl]piperidine-1-carbothioamide Openeye Name: (3S)-3-(hydroxymethyl)-N-[2-(4-methoxyphenyl)ethyl]piperidine-1-carbothioamide CAS Name: (3S)-3-(hydroxymethyl)-N-[2-(4-methoxyphenyl)ethyl]-1-piperidinecarbothioamide IUPAC Name: (3S)-3-(hydroxymethyl)-N-[2-(4-methoxyphenyl)ethyl]piperidine-1-carbothioamide Traditional Name: (3S)-N-[2-(4-methoxyphenyl)ethyl]-3-methylol-piperidine-1-carbothioamide Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)N2CCCC(C2)CO

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)N2CCC[C@@H](C2)CO

InChI

InChI=1S/C16H24N2O2S/c1-20-15-6-4-13(5-7-15)8-9-17-16(21)18-10-2-3-14(11-18)12-19/h4-7,14,19H,2-3,8-12H2,1H3,(H,17,21)/t14-/m0/s1