propan-2-yl 4-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl-propan-2-yl-amino]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl-propan-2-yl-amino]piperidine-1-carboxylate Openeye Name: isopropyl 4-[isopropyl-[[6-(4-methylsulfonylphenyl)-3-pyridyl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[[6-(4-methylsulfonylphenyl)-3-pyridinyl]methyl-propan-2-ylamino]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl-propan-2-ylamino]piperidine-1-carboxylate Traditional Name: 4-[isopropyl-[[6-(4-mesylphenyl)-3-pyridyl]methyl]amino]piperidine-1-carboxylic acid isopropyl ester Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O4S/c1-18(2)28(22-12-14-27(15-13-22)25(29)32-19(3)4)17-20-6-11-24(26-16-20)21-7-9-23(10-8-21)33(5,30)31/h6-11,16,18-19,22H,12-15,17H2,1-5H3