3-[3-[(7-azanyl-2H-indazol-3-yl)methyl]-6-bromanyl-2-fluoranyl-phenoxy]-5-chloranyl-benzenecarbonitrile

Systemtic Name: 3-[3-[(7-azanyl-2H-indazol-3-yl)methyl]-6-bromanyl-2-fluoranyl-phenoxy]-5-chloranyl-benzenecarbonitrile Openeye Name: 3-[3-[(7-amino-2H-indazol-3-yl)methyl]-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile CAS Name: 3-[3-[(7-amino-2H-indazol-3-yl)methyl]-6-bromo-2-fluorophenoxy]-5-chlorobenzonitrile IUPAC Name: 3-[3-[(7-amino-2H-indazol-3-yl)methyl]-6-bromo-2-fluorophenoxy]-5-chlorobenzonitrile Traditional Name: 3-[3-[(7-amino-2H-indazol-3-yl)methyl]-6-bromo-2-fluoro-phenoxy]-5-chloro-benzonitrile Formula: C21H13BrClFN4O MolecularWeight: 471.709523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(NN=C2C(=C1)N)CC3=C(C(=C(C=C3)Br)OC4=CC(=CC(=C4)C#N)Cl)F

Isomeric SMILES

C1=CC2=C(NN=C2C(=C1)N)CC3=C(C(=C(C=C3)Br)OC4=CC(=CC(=C4)C#N)Cl)F

InChI

InChI=1S/C21H13BrClFN4O/c22-16-5-4-12(8-18-15-2-1-3-17(26)20(15)28-27-18)19(24)21(16)29-14-7-11(10-25)6-13(23)9-14/h1-7,9H,8,26H2,(H,27,28)