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

Systemtic Name: tert-butyl 4-[2-hydroxyethyl-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-hydroxyethyl-[[6-(4-methylsulfonylphenyl)-3-pyridyl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[2-hydroxyethyl-[[6-(4-methylsulfonylphenyl)-3-pyridinyl]methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-hydroxyethyl-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[2-hydroxyethyl-[[6-(4-mesylphenyl)-3-pyridyl]methyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H35N3O5S MolecularWeight: 489.6275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O5S/c1-25(2,3)33-24(30)27-13-11-21(12-14-27)28(15-16-29)18-19-5-10-23(26-17-19)20-6-8-22(9-7-20)34(4,31)32/h5-10,17,21,29H,11-16,18H2,1-4H3