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

Systemtic Name: 3-(hydroxymethyl)-N-(4-phenoxyphenyl)piperidine-1-carbothioamide Openeye Name: 3-(hydroxymethyl)-N-(4-phenoxyphenyl)piperidine-1-carbothioamide CAS Name: 3-(hydroxymethyl)-N-(4-phenoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: 3-(hydroxymethyl)-N-(4-phenoxyphenyl)piperidine-1-carbothioamide Traditional Name: 3-methylol-N-(4-phenoxyphenyl)piperidine-1-carbothioamide Formula: C19H22N2O2S MolecularWeight: 342.45518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)CO

Isomeric SMILES

C1CC(CN(C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)CO

InChI

InChI=1S/C19H22N2O2S/c22-14-15-5-4-12-21(13-15)19(24)20-16-8-10-18(11-9-16)23-17-6-2-1-3-7-17/h1-3,6-11,15,22H,4-5,12-14H2,(H,20,24)