1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-(1H-indol-3-ylsulfanyl)ethanone

Systemtic Name: 1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-(1H-indol-3-ylsulfanyl)ethanone Openeye Name: 1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-(1H-indol-3-ylsulfanyl)ethanone CAS Name: 1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-(1H-indol-3-ylthio)ethanone IUPAC Name: 1-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-(1H-indol-3-ylsulfanyl)ethanone Traditional Name: 1-[3,5-bis(4-methoxyphenyl)-2-pyrazolin-1-yl]-2-(1H-indol-3-ylthio)ethanone Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=CNC4=CC=CC=C43)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=CNC4=CC=CC=C43)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H25N3O3S/c1-32-20-11-7-18(8-12-20)24-15-25(19-9-13-21(33-2)14-10-19)30(29-24)27(31)17-34-26-16-28-23-6-4-3-5-22(23)26/h3-14,16,25,28H,15,17H2,1-2H3