N-(4-ethylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide

Systemtic Name: N-(4-ethylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Openeye Name: N-(4-ethylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide CAS Name: N-(4-ethylphenyl)-3-(hydroxymethyl)-1-piperidinecarbothioamide IUPAC Name: N-(4-ethylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Traditional Name: N-(4-ethylphenyl)-3-methylol-piperidine-1-carbothioamide Formula: C15H22N2OS MolecularWeight: 278.41298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N2CCCC(C2)CO

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N2CCCC(C2)CO

InChI

InChI=1S/C15H22N2OS/c1-2-12-5-7-14(8-6-12)16-15(19)17-9-3-4-13(10-17)11-18/h5-8,13,18H,2-4,9-11H2,1H3,(H,16,19)