O-[1-(4-methylphenyl)-3-piperidin-1-yl-propyl] N-phenylcarbamothioate hydrochloride

Systemtic Name: O-[1-(4-methylphenyl)-3-piperidin-1-yl-propyl] N-phenylcarbamothioate hydrochloride Openeye Name: O-[3-(1-piperidyl)-1-(p-tolyl)propyl] N-phenylcarbamothioate hydrochloride CAS Name: N-phenylcarbamothioic acid O-[1-(4-methylphenyl)-3-(1-piperidinyl)propyl] ester hydrochloride IUPAC Name: O-[1-(4-methylphenyl)-3-piperidin-1-ylpropyl] N-phenylcarbamothioate hydrochloride Traditional Name: N-phenylthiocarbamic acid O-[3-piperidino-1-(p-tolyl)propyl] ester hydrochloride Formula: C22H29ClN2OS MolecularWeight: 404.99646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCN2CCCCC2)OC(=S)NC3=CC=CC=C3.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(CCN2CCCCC2)OC(=S)NC3=CC=CC=C3.Cl

InChI

InChI=1S/C22H28N2OS.ClH/c1-18-10-12-19(13-11-18)21(14-17-24-15-6-3-7-16-24)25-22(26)23-20-8-4-2-5-9-20;/h2,4-5,8-13,21H,3,6-7,14-17H2,1H3,(H,23,26);1H