2-[[3-(hydroxymethyl)piperidin-1-yl]methyl]benzenecarbothioamide

Systemtic Name: 2-[[3-(hydroxymethyl)piperidin-1-yl]methyl]benzenecarbothioamide Openeye Name: 2-[[3-(hydroxymethyl)-1-piperidyl]methyl]benzenecarbothioamide CAS Name: 2-[[3-(hydroxymethyl)-1-piperidinyl]methyl]benzenecarbothioamide IUPAC Name: 2-[[3-(hydroxymethyl)piperidin-1-yl]methyl]benzenecarbothioamide Traditional Name: 2-[(3-methylolpiperidino)methyl]thiobenzamide Formula: C14H20N2OS MolecularWeight: 264.3864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2C(=S)N)CO

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC=C2C(=S)N)CO

InChI

InChI=1S/C14H20N2OS/c15-14(18)13-6-2-1-5-12(13)9-16-7-3-4-11(8-16)10-17/h1-2,5-6,11,17H,3-4,7-10H2,(H2,15,18)