4-[5-[5,5-dimethyl-4-oxidanylidene-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-1-yl]pentyl]-N-ethyl-piperazine-1-carbothioamide

Systemtic Name: 4-[5-[5,5-dimethyl-4-oxidanylidene-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-sulfanylidene-imidazolidin-1-yl]pentyl]-N-ethyl-piperazine-1-carbothioamide Openeye Name: 4-[5-[5,5-dimethyl-4-oxo-3-(1-oxo-3H-isobenzofuran-5-yl)-2-thioxo-imidazolidin-1-yl]pentyl]-N-ethyl-piperazine-1-carbothioamide CAS Name: 4-[5-[5,5-dimethyl-4-oxo-3-(1-oxo-3H-isobenzofuran-5-yl)-2-sulfanylidene-1-imidazolidinyl]pentyl]-N-ethyl-1-piperazinecarbothioamide IUPAC Name: 4-[5-[5,5-dimethyl-4-oxo-3-(1-oxo-3H-2-benzofuran-5-yl)-2-sulfanylideneimidazolidin-1-yl]pentyl]-N-ethylpiperazine-1-carbothioamide Traditional Name: N-ethyl-4-[5-[4-keto-3-(1-ketophthalan-5-yl)-5,5-dimethyl-2-thioxo-imidazolidin-1-yl]pentyl]piperazine-1-carbothioamide Formula: C25H35N5O3S2 MolecularWeight: 517.7071

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN(CC1)CCCCCN2C(=S)N(C(=O)C2(C)C)C3=CC4=C(C=C3)C(=O)OC4

Isomeric SMILES

CCNC(=S)N1CCN(CC1)CCCCCN2C(=S)N(C(=O)C2(C)C)C3=CC4=C(C=C3)C(=O)OC4

InChI

InChI=1S/C25H35N5O3S2/c1-4-26-23(34)28-14-12-27(13-15-28)10-6-5-7-11-29-24(35)30(22(32)25(29,2)3)19-8-9-20-18(16-19)17-33-21(20)31/h8-9,16H,4-7,10-15,17H2,1-3H3,(H,26,34)