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

Systemtic Name: tert-butyl 4-[3-[[(4-methylsulfonylphenyl)methylamino]methyl]pyridin-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-[[(4-methylsulfonylphenyl)methylamino]methyl]-2-pyridyl]piperidine-1-carboxylate CAS Name: 4-[3-[[(4-methylsulfonylphenyl)methylamino]methyl]-2-pyridinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[[(4-methylsulfonylphenyl)methylamino]methyl]pyridin-2-yl]piperidine-1-carboxylate Traditional Name: 4-[3-[[(4-mesylbenzyl)amino]methyl]-2-pyridyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H33N3O4S MolecularWeight: 459.60152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=CC=N2)CNCC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=CC=N2)CNCC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C24H33N3O4S/c1-24(2,3)31-23(28)27-14-11-19(12-15-27)22-20(6-5-13-26-22)17-25-16-18-7-9-21(10-8-18)32(4,29)30/h5-10,13,19,25H,11-12,14-17H2,1-4H3