tert-butyl 4-[4-aminocarbonyl-6-[2-(cyclohexylamino)pyridin-4-yl]pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-aminocarbonyl-6-[2-(cyclohexylamino)pyridin-4-yl]pyridin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-carbamoyl-6-[2-(cyclohexylamino)-4-pyridyl]-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[4-carbamoyl-6-[2-(cyclohexylamino)-4-pyridinyl]-2-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-carbamoyl-6-[2-(cyclohexylamino)pyridin-4-yl]pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-carbamoyl-6-[2-(cyclohexylamino)-4-pyridyl]-2-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H36N6O3 MolecularWeight: 480.60244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC(=N2)C3=CC(=NC=C3)NC4CCCCC4)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC(=N2)C3=CC(=NC=C3)NC4CCCCC4)C(=O)N

InChI

InChI=1S/C26H36N6O3/c1-26(2,3)35-25(34)32-13-11-31(12-14-32)23-17-19(24(27)33)15-21(30-23)18-9-10-28-22(16-18)29-20-7-5-4-6-8-20/h9-10,15-17,20H,4-8,11-14H2,1-3H3,(H2,27,33)(H,28,29)