1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-5-thiophen-2-yl-pentane-1,5-dione

Systemtic Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-5-thiophen-2-yl-pentane-1,5-dione Openeye Name: 1-(4-indan-5-ylsulfonylpiperazin-1-yl)-5-(2-thienyl)pentane-1,5-dione CAS Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-5-thiophen-2-ylpentane-1,5-dione IUPAC Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-5-thiophen-2-ylpentane-1,5-dione Traditional Name: 1-(4-indan-5-ylsulfonylpiperazino)-5-(2-thienyl)pentane-1,5-dione Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCCC(=O)C4=CC=CS4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCCC(=O)C4=CC=CS4

InChI

InChI=1S/C22H26N2O4S2/c25-20(21-7-3-15-29-21)6-2-8-22(26)23-11-13-24(14-12-23)30(27,28)19-10-9-17-4-1-5-18(17)16-19/h3,7,9-10,15-16H,1-2,4-6,8,11-14H2