4-(4-butylpiperidin-1-yl)-1-[2-(2-sulfanylethyl)phenyl]butan-1-one

Systemtic Name: 4-(4-butylpiperidin-1-yl)-1-[2-(2-sulfanylethyl)phenyl]butan-1-one Openeye Name: 4-(4-butyl-1-piperidyl)-1-[2-(2-sulfanylethyl)phenyl]butan-1-one CAS Name: 4-(4-butyl-1-piperidinyl)-1-[2-(2-mercaptoethyl)phenyl]-1-butanone IUPAC Name: 4-(4-butylpiperidin-1-yl)-1-[2-(2-sulfanylethyl)phenyl]butan-1-one Traditional Name: 4-(4-butylpiperidino)-1-[2-(2-mercaptoethyl)phenyl]butan-1-one Formula: C21H33NOS MolecularWeight: 347.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)CCCC(=O)C2=CC=CC=C2CCS

Isomeric SMILES

CCCCC1CCN(CC1)CCCC(=O)C2=CC=CC=C2CCS

InChI

InChI=1S/C21H33NOS/c1-2-3-7-18-11-15-22(16-12-18)14-6-10-21(23)20-9-5-4-8-19(20)13-17-24/h4-5,8-9,18,24H,2-3,6-7,10-17H2,1H3