propan-2-yl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]methyl]amino]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]methyl]amino]piperidine-1-carboxylate Openeye Name: isopropyl 4-[methyl-[[5-(4-methylsulfonylphenyl)-2-pyridyl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[[5-(4-methylsulfonylphenyl)-2-pyridinyl]methyl]amino]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-mesylphenyl)-2-pyridyl]methyl-methyl-amino]piperidine-1-carboxylic acid isopropyl ester Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H31N3O4S/c1-17(2)30-23(27)26-13-11-21(12-14-26)25(3)16-20-8-5-19(15-24-20)18-6-9-22(10-7-18)31(4,28)29/h5-10,15,17,21H,11-14,16H2,1-4H3