2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-indan-5-ylsulfanyl-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-1-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(indan-5-ylthio)-1-[4-(4-methoxyphenyl)sulfonylpiperazino]ethanone Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H26N2O4S2/c1-28-19-6-9-21(10-7-19)30(26,27)24-13-11-23(12-14-24)22(25)16-29-20-8-5-17-3-2-4-18(17)15-20/h5-10,15H,2-4,11-14,16H2,1H3