1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-2-(1-propylindol-3-yl)sulfanyl-ethanone

Systemtic Name: 1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-2-(1-propylindol-3-yl)sulfanyl-ethanone Openeye Name: 1-[3-(4-methoxyphenyl)-5-(2-thienyl)-1,3-dihydropyrazol-2-yl]-2-(1-propylindol-3-yl)sulfanyl-ethanone CAS Name: 1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-2-[(1-propyl-3-indolyl)thio]ethanone IUPAC Name: 1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-1,3-dihydropyrazol-2-yl]-2-(1-propylindol-3-yl)sulfanylethanone Traditional Name: 1-[5-(4-methoxyphenyl)-3-(2-thienyl)-3-pyrazolin-1-yl]-2-[(1-propylindol-3-yl)thio]ethanone Formula: C27H27N3O2S2 MolecularWeight: 489.65218

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=CC=CC=C21)SCC(=O)N3C(C=C(N3)C4=CC=CS4)C5=CC=C(C=C5)OC

Isomeric SMILES

CCCN1C=C(C2=CC=CC=C21)SCC(=O)N3C(C=C(N3)C4=CC=CS4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H27N3O2S2/c1-3-14-29-17-26(21-7-4-5-8-23(21)29)34-18-27(31)30-24(19-10-12-20(32-2)13-11-19)16-22(28-30)25-9-6-15-33-25/h4-13,15-17,24,28H,3,14,18H2,1-2H3