1-[5-(4-bromophenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-[1-[(4-fluorophenyl)methyl]indol-3-yl]sulfanyl-ethanone

Systemtic Name: 1-[5-(4-bromophenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-[1-[(4-fluorophenyl)methyl]indol-3-yl]sulfanyl-ethanone Openeye Name: 1-[5-(4-bromophenyl)-3-(p-tolyl)-3,4-dihydropyrazol-2-yl]-2-[1-[(4-fluorophenyl)methyl]indol-3-yl]sulfanyl-ethanone CAS Name: 1-[5-(4-bromophenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-[[1-[(4-fluorophenyl)methyl]-3-indolyl]thio]ethanone IUPAC Name: 1-[5-(4-bromophenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-[1-[(4-fluorophenyl)methyl]indol-3-yl]sulfanylethanone Traditional Name: 1-[3-(4-bromophenyl)-5-(p-tolyl)-2-pyrazolin-1-yl]-2-[[1-(4-fluorobenzyl)indol-3-yl]thio]ethanone Formula: C33H27BrFN3OS MolecularWeight: 612.554383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)F)C6=CC=C(C=C6)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)F)C6=CC=C(C=C6)Br

InChI

InChI=1S/C33H27BrFN3OS/c1-22-6-10-25(11-7-22)31-18-29(24-12-14-26(34)15-13-24)36-38(31)33(39)21-40-32-20-37(30-5-3-2-4-28(30)32)19-23-8-16-27(35)17-9-23/h2-17,20,31H,18-19,21H2,1H3