(3E)-6-chloranyl-5-fluoranyl-3-[(6-nitrosulfanyl-2-oxidanylidene-hexoxy)-thiophen-2-yl-methylidene]-2-oxidanylidene-indole-1-carboxamide

Systemtic Name: (3E)-6-chloranyl-5-fluoranyl-3-[(6-nitrosulfanyl-2-oxidanylidene-hexoxy)-thiophen-2-yl-methylidene]-2-oxidanylidene-indole-1-carboxamide Openeye Name: (3E)-6-chloro-5-fluoro-3-[(6-nitrosulfanyl-2-oxo-hexoxy)-(2-thienyl)methylene]-2-oxo-indoline-1-carboxamide CAS Name: (3E)-6-chloro-5-fluoro-3-[[6-(nitrothio)-2-oxohexoxy]-thiophen-2-ylmethylidene]-2-oxo-1-indolecarboxamide IUPAC Name: (3E)-6-chloro-5-fluoro-3-[(6-nitrosulfanyl-2-oxohexoxy)-thiophen-2-ylmethylidene]-2-oxoindole-1-carboxamide Traditional Name: (3E)-6-chloro-5-fluoro-2-keto-3-[[2-keto-6-(nitrothio)hexoxy]-(2-thienyl)methylene]indoline-1-carboxamide Formula: C20H17ClFN3O6S2 MolecularWeight: 513.946883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=C2C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)OCC(=O)CCCCS[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)/C(=C\2/C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)/OCC(=O)CCCCS[N+](=O)[O-]

InChI

InChI=1S/C20H17ClFN3O6S2/c21-13-9-15-12(8-14(13)22)17(19(27)24(15)20(23)28)18(16-5-3-6-32-16)31-10-11(26)4-1-2-7-33-25(29)30/h3,5-6,8-9H,1-2,4,7,10H2,(H2,23,28)/b18-17+