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

Systemtic Name: 1-[8-(4-ethanoylpiperazin-1-yl)octyl]-5,5-dimethyl-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: 1-[8-(4-acetylpiperazin-1-yl)octyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-thioxo-imidazolidin-4-one CAS Name: 1-[8-(4-acetyl-1-piperazinyl)octyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-sulfanylidene-4-imidazolidinone IUPAC Name: 1-[8-(4-acetylpiperazin-1-yl)octyl]-5,5-dimethyl-3-(1-oxo-3H-2-benzofuran-5-yl)-2-sulfanylideneimidazolidin-4-one Traditional Name: 1-[8-(4-acetylpiperazino)octyl]-3-(1-ketophthalan-5-yl)-5,5-dimethyl-2-thioxo-4-imidazolidinone Formula: C27H38N4O4S MolecularWeight: 514.68002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38N4O4S/c1-20(32)29-16-14-28(15-17-29)12-8-6-4-5-7-9-13-30-26(36)31(25(34)27(30,2)3)22-10-11-23-21(18-22)19-35-24(23)33/h10-11,18H,4-9,12-17,19H2,1-3H3