S-[1-(phenylmethyl)piperidin-3-yl] benzenecarbothioate

Systemtic Name: S-[1-(phenylmethyl)piperidin-3-yl] benzenecarbothioate Openeye Name: S-(1-benzyl-3-piperidyl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-[1-(phenylmethyl)-3-piperidinyl] ester IUPAC Name: S-(1-benzylpiperidin-3-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(1-benzyl-3-piperidyl) ester Formula: C19H21NOS MolecularWeight: 311.44114

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2)SC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC=C2)SC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21NOS/c21-19(17-10-5-2-6-11-17)22-18-12-7-13-20(15-18)14-16-8-3-1-4-9-16/h1-6,8-11,18H,7,12-15H2