4-bromanyl-1-[(4-chloranylpyrazol-1-yl)methyl]-3,5-bis(4-methoxyphenyl)pyrazole

Systemtic Name: 4-bromanyl-1-[(4-chloranylpyrazol-1-yl)methyl]-3,5-bis(4-methoxyphenyl)pyrazole Openeye Name: 4-bromo-1-[(4-chloropyrazol-1-yl)methyl]-3,5-bis(4-methoxyphenyl)pyrazole CAS Name: 4-bromo-1-[(4-chloro-1-pyrazolyl)methyl]-3,5-bis(4-methoxyphenyl)pyrazole IUPAC Name: 4-bromo-1-[(4-chloropyrazol-1-yl)methyl]-3,5-bis(4-methoxyphenyl)pyrazole Traditional Name: 4-bromo-1-[(4-chloropyrazol-1-yl)methyl]-3,5-bis(4-methoxyphenyl)pyrazole Formula: C21H18BrClN4O2 MolecularWeight: 473.75022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NN2CN3C=C(C=N3)Cl)C4=CC=C(C=C4)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NN2CN3C=C(C=N3)Cl)C4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C21H18BrClN4O2/c1-28-17-7-3-14(4-8-17)20-19(22)21(15-5-9-18(29-2)10-6-15)27(25-20)13-26-12-16(23)11-24-26/h3-12H,13H2,1-2H3