1-(2,3-dihydroindol-1-yl)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-1-indolin-1-yl-ethanone CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[[6-(3,4-dimethoxyphenyl)-3-pyridazinyl]thio]ethanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanylethanone Traditional Name: 2-[[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]thio]-1-indolin-1-yl-ethanone Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)N3CCC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)N3CCC4=CC=CC=C43)OC

InChI

InChI=1S/C22H21N3O3S/c1-27-19-9-7-16(13-20(19)28-2)17-8-10-21(24-23-17)29-14-22(26)25-12-11-15-5-3-4-6-18(15)25/h3-10,13H,11-12,14H2,1-2H3