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

Systemtic Name: tert-butyl 4-[[methyl-[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[methyl-[5-(4-methylsulfonylphenyl)-2-pyridyl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[methyl-[5-(4-methylsulfonylphenyl)-2-pyridinyl]amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[methyl-[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[5-(4-mesylphenyl)-2-pyridyl]-methyl-amino]methyl]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)CN(C)C2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C24H33N3O4S/c1-24(2,3)31-23(28)27-14-12-18(13-15-27)17-26(4)22-11-8-20(16-25-22)19-6-9-21(10-7-19)32(5,29)30/h6-11,16,18H,12-15,17H2,1-5H3