S-[[1-(2,2-diphenylethyl)piperidin-3-yl]methyl] ethanethioate

Systemtic Name: S-[[1-(2,2-diphenylethyl)piperidin-3-yl]methyl] ethanethioate Openeye Name: S-[[1-(2,2-diphenylethyl)-3-piperidyl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[1-(2,2-diphenylethyl)-3-piperidinyl]methyl] ester IUPAC Name: S-[[1-(2,2-diphenylethyl)piperidin-3-yl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[[1-(2,2-diphenylethyl)-3-piperidyl]methyl] ester Formula: C22H27NOS MolecularWeight: 353.52088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CCCN(C1)CC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SCC1CCCN(C1)CC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H27NOS/c1-18(24)25-17-19-9-8-14-23(15-19)16-22(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-7,10-13,19,22H,8-9,14-17H2,1H3