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

Systemtic Name: 5-bromanyl-N2-(1H-indazol-5-yl)-N4-(4-pyrazin-2-yloxyphenyl)pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-(1H-indazol-5-yl)-N4-(4-pyrazin-2-yloxyphenyl)pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-(1H-indazol-5-yl)-N4-[4-(2-pyrazinyloxy)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-(1H-indazol-5-yl)-4-N-(4-pyrazin-2-yloxyphenyl)pyrimidine-2,4-diamine Traditional Name: [5-bromo-2-(1H-indazol-5-ylamino)pyrimidin-4-yl]-(4-pyrazin-2-yloxyphenyl)amine Formula: C21H15BrN8O MolecularWeight: 475.3008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)NN=C4)OC5=NC=CN=C5

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)NN=C4)OC5=NC=CN=C5

InChI

InChI=1S/C21H15BrN8O/c22-17-11-25-21(28-15-3-6-18-13(9-15)10-26-30-18)29-20(17)27-14-1-4-16(5-2-14)31-19-12-23-7-8-24-19/h1-12H,(H,26,30)(H2,25,27,28,29)