(3S)-3-(4-bromophenyl)-5-(2,4-dimethoxyphenyl)-2-phenyl-3,4-dihydropyrazole

Systemtic Name: (3S)-3-(4-bromophenyl)-5-(2,4-dimethoxyphenyl)-2-phenyl-3,4-dihydropyrazole Openeye Name: (3S)-3-(4-bromophenyl)-5-(2,4-dimethoxyphenyl)-2-phenyl-3,4-dihydropyrazole CAS Name: (3S)-3-(4-bromophenyl)-5-(2,4-dimethoxyphenyl)-2-phenyl-3,4-dihydropyrazole IUPAC Name: (3S)-3-(4-bromophenyl)-5-(2,4-dimethoxyphenyl)-2-phenyl-3,4-dihydropyrazole Traditional Name: (5S)-5-(4-bromophenyl)-3-(2,4-dimethoxyphenyl)-1-phenyl-2-pyrazoline Formula: C23H21BrN2O2 MolecularWeight: 437.32904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN([C@@H](C2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

InChI

InChI=1S/C23H21BrN2O2/c1-27-19-12-13-20(23(14-19)28-2)21-15-22(16-8-10-17(24)11-9-16)26(25-21)18-6-4-3-5-7-18/h3-14,22H,15H2,1-2H3/t22-/m0/s1