1-[4-(3-methylbutylsulfanyl)phenyl]-3-piperidin-1-yl-propan-1-one hydrochloride

Systemtic Name: 1-[4-(3-methylbutylsulfanyl)phenyl]-3-piperidin-1-yl-propan-1-one hydrochloride Openeye Name: 1-(4-isopentylsulfanylphenyl)-3-(1-piperidyl)propan-1-one hydrochloride CAS Name: 1-[4-(3-methylbutylthio)phenyl]-3-(1-piperidinyl)-1-propanone hydrochloride IUPAC Name: 1-[4-(3-methylbutylsulfanyl)phenyl]-3-piperidin-1-ylpropan-1-one hydrochloride Traditional Name: 1-[4-(isoamylthio)phenyl]-3-piperidino-propan-1-one hydrochloride Formula: C19H30ClNOS MolecularWeight: 355.9656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl

Isomeric SMILES

CC(C)CCSC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl

InChI

InChI=1S/C19H29NOS.ClH/c1-16(2)11-15-22-18-8-6-17(7-9-18)19(21)10-14-20-12-4-3-5-13-20;/h6-9,16H,3-5,10-15H2,1-2H3;1H