[4-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]piperazin-1-yl]-(4-methylsulfonylphenyl)methanone

Systemtic Name: [4-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]piperazin-1-yl]-(4-methylsulfonylphenyl)methanone Openeye Name: [4-[4-[(1-cyclobutyl-4-piperidyl)oxy]phenyl]piperazin-1-yl]-(4-methylsulfonylphenyl)methanone CAS Name: [4-[4-[(1-cyclobutyl-4-piperidinyl)oxy]phenyl]-1-piperazinyl]-(4-methylsulfonylphenyl)methanone IUPAC Name: [4-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]piperazin-1-yl]-(4-methylsulfonylphenyl)methanone Traditional Name: [4-[4-[(1-cyclobutyl-4-piperidyl)oxy]phenyl]piperazino]-(4-mesylphenyl)methanone Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC4CCN(CC4)C5CCC5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC4CCN(CC4)C5CCC5

InChI

InChI=1S/C27H35N3O4S/c1-35(32,33)26-11-5-21(6-12-26)27(31)30-19-17-29(18-20-30)23-7-9-24(10-8-23)34-25-13-15-28(16-14-25)22-3-2-4-22/h5-12,22,25H,2-4,13-20H2,1H3