1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-[(2-methylsulfanylphenyl)amino]ethanone

Systemtic Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-[(2-methylsulfanylphenyl)amino]ethanone Openeye Name: 1-(4-indan-5-ylsulfonylpiperazin-1-yl)-2-(2-methylsulfanylanilino)ethanone CAS Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-[2-(methylthio)anilino]ethanone IUPAC Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-(2-methylsulfanylanilino)ethanone Traditional Name: 1-(4-indan-5-ylsulfonylpiperazino)-2-[2-(methylthio)anilino]ethanone Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CSC1=CC=CC=C1NCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H27N3O3S2/c1-29-21-8-3-2-7-20(21)23-16-22(26)24-11-13-25(14-12-24)30(27,28)19-10-9-17-5-4-6-18(17)15-19/h2-3,7-10,15,23H,4-6,11-14,16H2,1H3