2-methyl-1-(4-phenylsulfanylphenyl)-2-piperidin-1-yl-propan-1-one

Systemtic Name: 2-methyl-1-(4-phenylsulfanylphenyl)-2-piperidin-1-yl-propan-1-one Openeye Name: 2-methyl-1-(4-phenylsulfanylphenyl)-2-(1-piperidyl)propan-1-one CAS Name: 2-methyl-1-[4-(phenylthio)phenyl]-2-(1-piperidinyl)-1-propanone IUPAC Name: 2-methyl-1-(4-phenylsulfanylphenyl)-2-piperidin-1-ylpropan-1-one Traditional Name: 2-methyl-1-[4-(phenylthio)phenyl]-2-piperidino-propan-1-one Formula: C21H25NOS MolecularWeight: 339.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)SC2=CC=CC=C2)N3CCCCC3

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)SC2=CC=CC=C2)N3CCCCC3

InChI

InChI=1S/C21H25NOS/c1-21(2,22-15-7-4-8-16-22)20(23)17-11-13-19(14-12-17)24-18-9-5-3-6-10-18/h3,5-6,9-14H,4,7-8,15-16H2,1-2H3