cyclobutyl 4-[methyl-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate

Systemtic Name: cyclobutyl 4-[methyl-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate Openeye Name: cyclobutyl 4-[methyl-[[6-(4-methylsulfonylphenyl)-3-pyridyl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[[6-(4-methylsulfonylphenyl)-3-pyridinyl]methyl]amino]-1-piperidinecarboxylic acid cyclobutyl ester IUPAC Name: cyclobutyl 4-[methyl-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[6-(4-mesylphenyl)-3-pyridyl]methyl-methyl-amino]piperidine-1-carboxylic acid cyclobutyl ester Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3CCN(CC3)C(=O)OC4CCC4

Isomeric SMILES

CN(CC1=CN=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3CCN(CC3)C(=O)OC4CCC4

InChI

InChI=1S/C24H31N3O4S/c1-26(20-12-14-27(15-13-20)24(28)31-21-4-3-5-21)17-18-6-11-23(25-16-18)19-7-9-22(10-8-19)32(2,29)30/h6-11,16,20-21H,3-5,12-15,17H2,1-2H3