1-[(3S)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-2-phenyl-ethanone

Systemtic Name: 1-[(3S)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-2-phenyl-ethanone Openeye Name: 1-[(3S)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-2-phenyl-ethanone CAS Name: 1-[(3S)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-2-phenylethanone IUPAC Name: 1-[(3S)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-2-phenylethanone Traditional Name: 1-[(5S)-3-(4-bromophenyl)-5-(4-methoxyphenyl)-3-pyrazolin-1-yl]-2-phenyl-ethanone Formula: C24H21BrN2O2 MolecularWeight: 449.33974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C=C(NN2C(=O)CC3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2C=C(NN2C(=O)CC3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H21BrN2O2/c1-29-21-13-9-19(10-14-21)23-16-22(18-7-11-20(25)12-8-18)26-27(23)24(28)15-17-5-3-2-4-6-17/h2-14,16,23,26H,15H2,1H3/t23-/m0/s1