2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-indan-5-ylsulfanyl-ethanone CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[5-(3,4-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-(indan-5-ylthio)ethanone Formula: C26H26N2O3S2 MolecularWeight: 478.62624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CSC3=CC4=C(CCC4)C=C3)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)CSC3=CC4=C(CCC4)C=C3)C5=CC=CS5)OC

InChI

InChI=1S/C26H26N2O3S2/c1-30-23-11-9-19(14-24(23)31-2)22-15-21(25-7-4-12-32-25)27-28(22)26(29)16-33-20-10-8-17-5-3-6-18(17)13-20/h4,7-14,22H,3,5-6,15-16H2,1-2H3