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

Systemtic Name: 1-[(3S)-3-(3-bromophenyl)-5-(4-bromophenyl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3S)-3-(3-bromophenyl)-5-(4-bromophenyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-3-(3-bromophenyl)-5-(4-bromophenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3S)-3-(3-bromophenyl)-5-(4-bromophenyl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5S)-5-(3-bromophenyl)-3-(4-bromophenyl)-2-pyrazolin-1-yl]ethanone Formula: C17H14Br2N2O MolecularWeight: 422.11386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Br)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(=O)N1[C@@H](CC(=N1)C2=CC=C(C=C2)Br)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H14Br2N2O/c1-11(22)21-17(13-3-2-4-15(19)9-13)10-16(20-21)12-5-7-14(18)8-6-12/h2-9,17H,10H2,1H3/t17-/m0/s1