3-methylsulfanyl-1-[3-(4-phenoxyphenyl)carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-methylsulfanyl-1-[3-(4-phenoxyphenyl)carbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-methylsulfanyl-1-[3-(4-phenoxybenzoyl)-1-piperidyl]propan-1-one CAS Name: 3-(methylthio)-1-[3-[oxo-(4-phenoxyphenyl)methyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-methylsulfanyl-1-[3-(4-phenoxybenzoyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(methylthio)-1-[3-(4-phenoxybenzoyl)piperidino]propan-1-one Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCCC(C1)C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CSCCC(=O)N1CCCC(C1)C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H25NO3S/c1-27-15-13-21(24)23-14-5-6-18(16-23)22(25)17-9-11-20(12-10-17)26-19-7-3-2-4-8-19/h2-4,7-12,18H,5-6,13-16H2,1H3