N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-bromanylpyrazol-1-yl)methyl]benzamide

Systemtic Name: N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-bromanylpyrazol-1-yl)methyl]benzamide Openeye Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-bromopyrazol-1-yl)methyl]benzamide CAS Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-3-[(4-bromo-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-3-[(4-bromopyrazol-1-yl)methyl]benzamide Traditional Name: N-[4-bromo-1-(4-fluorobenzyl)pyrazol-3-yl]-3-[(4-bromopyrazol-1-yl)methyl]benzamide Formula: C21H16Br2FN5O MolecularWeight: 533.191043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=C(C=N2)Br)C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=C(C=N2)Br)C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H16Br2FN5O/c22-17-9-25-28(12-17)11-15-2-1-3-16(8-15)21(30)26-20-19(23)13-29(27-20)10-14-4-6-18(24)7-5-14/h1-9,12-13H,10-11H2,(H,26,27,30)