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

Systemtic Name: 2-[3-[3-(hydroxymethyl)piperidin-1-yl]propoxy]benzenecarbothioamide Openeye Name: 2-[3-[3-(hydroxymethyl)-1-piperidyl]propoxy]benzenecarbothioamide CAS Name: 2-[3-[3-(hydroxymethyl)-1-piperidinyl]propoxy]benzenecarbothioamide IUPAC Name: 2-[3-[3-(hydroxymethyl)piperidin-1-yl]propoxy]benzenecarbothioamide Traditional Name: 2-[3-(3-methylolpiperidino)propoxy]thiobenzamide Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCOC2=CC=CC=C2C(=S)N)CO

Isomeric SMILES

C1CC(CN(C1)CCCOC2=CC=CC=C2C(=S)N)CO

InChI

InChI=1S/C16H24N2O2S/c17-16(21)14-6-1-2-7-15(14)20-10-4-9-18-8-3-5-13(11-18)12-19/h1-2,6-7,13,19H,3-5,8-12H2,(H2,17,21)