S-(2-piperidin-1-ylethyl) 3-propylbenzenecarbothioate

Systemtic Name: S-(2-piperidin-1-ylethyl) 3-propylbenzenecarbothioate Openeye Name: S-[2-(1-piperidyl)ethyl] 3-propylbenzenecarbothioate CAS Name: 3-propylbenzenecarbothioic acid S-[2-(1-piperidinyl)ethyl] ester IUPAC Name: S-(2-piperidin-1-ylethyl) 3-propylbenzenecarbothioate Traditional Name: 3-propylthiobenzoic acid S-(2-piperidinoethyl) ester Formula: C17H25NOS MolecularWeight: 291.4515

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1)C(=O)SCCN2CCCCC2

Isomeric SMILES

CCCC1=CC=CC(=C1)C(=O)SCCN2CCCCC2

InChI

InChI=1S/C17H25NOS/c1-2-7-15-8-6-9-16(14-15)17(19)20-13-12-18-10-4-3-5-11-18/h6,8-9,14H,2-5,7,10-13H2,1H3