3-bromanyl-2-(4-chloranyl-2-fluoranyl-5-pyrimidin-2-yloxy-phenyl)-4,5,6,7-tetrahydroindazole

Systemtic Name: 3-bromanyl-2-(4-chloranyl-2-fluoranyl-5-pyrimidin-2-yloxy-phenyl)-4,5,6,7-tetrahydroindazole Openeye Name: 3-bromo-2-(4-chloro-2-fluoro-5-pyrimidin-2-yloxy-phenyl)-4,5,6,7-tetrahydroindazole CAS Name: 3-bromo-2-[4-chloro-2-fluoro-5-(2-pyrimidinyloxy)phenyl]-4,5,6,7-tetrahydroindazole IUPAC Name: 3-bromo-2-(4-chloro-2-fluoro-5-pyrimidin-2-yloxyphenyl)-4,5,6,7-tetrahydroindazole Traditional Name: 3-bromo-2-[4-chloro-2-fluoro-5-(2-pyrimidyloxy)phenyl]-4,5,6,7-tetrahydroindazole Formula: C17H13BrClFN4O MolecularWeight: 423.666723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN(C(=C2C1)Br)C3=CC(=C(C=C3F)Cl)OC4=NC=CC=N4

Isomeric SMILES

C1CCC2=NN(C(=C2C1)Br)C3=CC(=C(C=C3F)Cl)OC4=NC=CC=N4

InChI

InChI=1S/C17H13BrClFN4O/c18-16-10-4-1-2-5-13(10)23-24(16)14-9-15(11(19)8-12(14)20)25-17-21-6-3-7-22-17/h3,6-9H,1-2,4-5H2