3-[4-(hydroxymethyl)piperidin-1-yl]carbonylbenzenecarbothioamide

Systemtic Name: 3-[4-(hydroxymethyl)piperidin-1-yl]carbonylbenzenecarbothioamide Openeye Name: 3-[4-(hydroxymethyl)piperidine-1-carbonyl]benzenecarbothioamide CAS Name: 3-[[4-(hydroxymethyl)-1-piperidinyl]-oxomethyl]benzenecarbothioamide IUPAC Name: 3-[4-(hydroxymethyl)piperidine-1-carbonyl]benzenecarbothioamide Traditional Name: 3-(4-methylolpiperidine-1-carbonyl)thiobenzamide Formula: C14H18N2O2S MolecularWeight: 278.36992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)C(=O)C2=CC(=CC=C2)C(=S)N

Isomeric SMILES

C1CN(CCC1CO)C(=O)C2=CC(=CC=C2)C(=S)N

InChI

InChI=1S/C14H18N2O2S/c15-13(19)11-2-1-3-12(8-11)14(18)16-6-4-10(9-17)5-7-16/h1-3,8,10,17H,4-7,9H2,(H2,15,19)