1-[6-(4-cyclopropylcarbonylpiperazin-1-yl)hexyl]-5,5-dimethyl-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 1-[6-(4-cyclopropylcarbonylpiperazin-1-yl)hexyl]-5,5-dimethyl-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-4-one Openeye Name: 1-[6-[4-(cyclopropanecarbonyl)piperazin-1-yl]hexyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-thioxo-imidazolidin-4-one CAS Name: 1-[6-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]hexyl]-5,5-dimethyl-3-(1-oxo-3H-isobenzofuran-5-yl)-2-sulfanylidene-4-imidazolidinone IUPAC Name: 1-[6-[4-(cyclopropanecarbonyl)piperazin-1-yl]hexyl]-5,5-dimethyl-3-(1-oxo-3H-2-benzofuran-5-yl)-2-sulfanylideneimidazolidin-4-one Traditional Name: 1-[6-[4-(cyclopropanecarbonyl)piperazino]hexyl]-3-(1-ketophthalan-5-yl)-5,5-dimethyl-2-thioxo-4-imidazolidinone Formula: C27H36N4O4S MolecularWeight: 512.66414

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=S)N1CCCCCCN2CCN(CC2)C(=O)C3CC3)C4=CC5=C(C=C4)C(=O)OC5)C

Isomeric SMILES

CC1(C(=O)N(C(=S)N1CCCCCCN2CCN(CC2)C(=O)C3CC3)C4=CC5=C(C=C4)C(=O)OC5)C

InChI

InChI=1S/C27H36N4O4S/c1-27(2)25(34)31(21-9-10-22-20(17-21)18-35-24(22)33)26(36)30(27)12-6-4-3-5-11-28-13-15-29(16-14-28)23(32)19-7-8-19/h9-10,17,19H,3-8,11-16,18H2,1-2H3