1-[8-(4-ethylsulfonylpiperazin-1-yl)octyl]-5,5-dimethyl-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 1-[8-(4-ethylsulfonylpiperazin-1-yl)octyl]-5,5-dimethyl-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: 1-[8-(4-ethylsulfonylpiperazin-1-yl)octyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-thioxo-imidazolidin-4-one CAS Name: 1-[8-(4-ethylsulfonyl-1-piperazinyl)octyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-sulfanylidene-4-imidazolidinone IUPAC Name: 1-[8-(4-ethylsulfonylpiperazin-1-yl)octyl]-5,5-dimethyl-3-(1-oxo-3H-2-benzofuran-5-yl)-2-sulfanylideneimidazolidin-4-one Traditional Name: 1-[8-(4-esylpiperazino)octyl]-3-(1-ketophthalan-5-yl)-5,5-dimethyl-2-thioxo-4-imidazolidinone Formula: C27H40N4O5S2 MolecularWeight: 564.7603

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CCCCCCCCN2C(=S)N(C(=O)C2(C)C)C3=CC4=C(C=C3)C(=O)OC4

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CCCCCCCCN2C(=S)N(C(=O)C2(C)C)C3=CC4=C(C=C3)C(=O)OC4

InChI

InChI=1S/C27H40N4O5S2/c1-4-38(34,35)29-17-15-28(16-18-29)13-9-7-5-6-8-10-14-30-26(37)31(25(33)27(30,2)3)22-11-12-23-21(19-22)20-36-24(23)32/h11-12,19H,4-10,13-18,20H2,1-3H3