1-[7-(4-ethyl-2-sulfonyl-piperazin-1-yl)heptyl]-5,5-dimethyl-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 1-[7-(4-ethyl-2-sulfonyl-piperazin-1-yl)heptyl]-5,5-dimethyl-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: 1-[7-(4-ethyl-2-sulfonyl-piperazin-1-yl)heptyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-thioxo-imidazolidin-4-one CAS Name: 1-[7-(4-ethyl-2-sulfonyl-1-piperazinyl)heptyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-sulfanylidene-4-imidazolidinone IUPAC Name: 1-[7-(4-ethyl-2-sulfonylpiperazin-1-yl)heptyl]-5,5-dimethyl-3-(1-oxo-3H-2-benzofuran-5-yl)-2-sulfanylideneimidazolidin-4-one Traditional Name: 1-[7-(4-ethyl-2-sulfonyl-piperazino)heptyl]-3-(1-ketophthalan-5-yl)-5,5-dimethyl-2-thioxo-4-imidazolidinone Formula: C26H36N4O5S2 MolecularWeight: 548.71784

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=S(=O)=O)C1)CCCCCCCN2C(=S)N(C(=O)C2(C)C)C3=CC4=C(C=C3)C(=O)OC4

Isomeric SMILES

CCN1CCN(C(=S(=O)=O)C1)CCCCCCCN2C(=S)N(C(=O)C2(C)C)C3=CC4=C(C=C3)C(=O)OC4

InChI

InChI=1S/C26H36N4O5S2/c1-4-27-14-15-28(22(17-27)37(33)34)12-8-6-5-7-9-13-29-25(36)30(24(32)26(29,2)3)20-10-11-21-19(16-20)18-35-23(21)31/h10-11,16H,4-9,12-15,17-18H2,1-3H3