tert-butyl 3-[2-azanyl-6-(5-propylcyclohex-3-en-1-yl)pyrimidin-4-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-azanyl-6-(5-propylcyclohex-3-en-1-yl)pyrimidin-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-amino-6-(5-propylcyclohex-3-en-1-yl)pyrimidin-4-yl]piperidine-1-carboxylate CAS Name: 3-[2-amino-6-(5-propyl-1-cyclohex-3-enyl)-4-pyrimidinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-amino-6-(5-propylcyclohex-3-en-1-yl)pyrimidin-4-yl]piperidine-1-carboxylate Traditional Name: 3-[2-amino-6-(5-propylcyclohex-3-en-1-yl)pyrimidin-4-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H36N4O2 MolecularWeight: 400.55754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(CC=C1)C2=CC(=NC(=N2)N)C3CCCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC1CC(CC=C1)C2=CC(=NC(=N2)N)C3CCCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H36N4O2/c1-5-8-16-9-6-10-17(13-16)19-14-20(26-21(24)25-19)18-11-7-12-27(15-18)22(28)29-23(2,3)4/h6,9,14,16-18H,5,7-8,10-13,15H2,1-4H3,(H2,24,25,26)