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

Systemtic Name: 1-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethanone Openeye Name: 1-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethanone CAS Name: 1-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-[(2-phenyl-1H-indol-3-yl)thio]ethanone IUPAC Name: 1-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-[(2-phenyl-1H-indol-3-yl)sulfanyl]ethanone Traditional Name: 1-[3-(4-bromophenyl)-5-(4-methoxyphenyl)-2-pyrazolin-1-yl]-2-[(2-phenyl-1H-indol-3-yl)thio]ethanone Formula: C32H26BrN3O2S MolecularWeight: 596.53674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C6=CC=C(C=C6)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C6=CC=C(C=C6)Br

InChI

InChI=1S/C32H26BrN3O2S/c1-38-25-17-13-22(14-18-25)29-19-28(21-11-15-24(33)16-12-21)35-36(29)30(37)20-39-32-26-9-5-6-10-27(26)34-31(32)23-7-3-2-4-8-23/h2-18,29,34H,19-20H2,1H3