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

Systemtic Name: 5-bromanyl-N2-(1H-indazol-5-yl)-N4-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-(1H-indazol-5-yl)-N4-(4-morpholinophenyl)pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-(1H-indazol-5-yl)-N4-[4-(4-morpholinyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-(1H-indazol-5-yl)-4-N-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine Traditional Name: [5-bromo-2-(1H-indazol-5-ylamino)pyrimidin-4-yl]-(4-morpholinophenyl)amine Formula: C21H20BrN7O MolecularWeight: 466.3338

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC(=NC=C3Br)NC4=CC5=C(C=C4)NN=C5

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC(=NC=C3Br)NC4=CC5=C(C=C4)NN=C5

InChI

InChI=1S/C21H20BrN7O/c22-18-13-23-21(26-16-3-6-19-14(11-16)12-24-28-19)27-20(18)25-15-1-4-17(5-2-15)29-7-9-30-10-8-29/h1-6,11-13H,7-10H2,(H,24,28)(H2,23,25,26,27)