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

Systemtic Name: 5-bromanyl-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine Openeye Name: 5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-(4-morpholinophenyl)pyrimidine-2,4-diamine CAS Name: 5-bromo-N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-[4-(4-morpholinyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine Traditional Name: [5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-(4-morpholinophenyl)amine Formula: C20H22BrN7O MolecularWeight: 456.33898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C20H22BrN7O/c21-16-12-22-20(25-19(16)24-18-11-17(26-27-18)13-1-2-13)23-14-3-5-15(6-4-14)28-7-9-29-10-8-28/h3-6,11-13H,1-2,7-10H2,(H3,22,23,24,25,26,27)