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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O4S/c1-6-27(21-13-15-28(16-14-21)24(29)32-25(2,3)4)18-19-7-12-23(26-17-19)20-8-10-22(11-9-20)33(5,30)31/h7-12,17,21H,6,13-16,18H2,1-5H3