5-bromanyl-N4-(5-cyclopentyl-1H-pyrazol-3-yl)-N2-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N4-(5-cyclopentyl-1H-pyrazol-3-yl)-N2-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine Openeye Name: 5-bromo-N4-(5-cyclopentyl-1H-pyrazol-3-yl)-N2-(4-morpholinophenyl)pyrimidine-2,4-diamine CAS Name: 5-bromo-N4-(5-cyclopentyl-1H-pyrazol-3-yl)-N2-[4-(4-morpholinyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-4-N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-N-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine Traditional Name: [5-bromo-4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-(4-morpholinophenyl)amine Formula: C22H26BrN7O MolecularWeight: 484.39214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CCC(C1)C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C22H26BrN7O/c23-18-14-24-22(25-16-5-7-17(8-6-16)30-9-11-31-12-10-30)27-21(18)26-20-13-19(28-29-20)15-3-1-2-4-15/h5-8,13-15H,1-4,9-12H2,(H3,24,25,26,27,28,29)