[(3Z)-3-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylhydrazinylidene]-5-bromanyl-2-oxidanylidene-indol-1-yl]methyl-dimethyl-azanium

Systemtic Name: [(3Z)-3-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylhydrazinylidene]-5-bromanyl-2-oxidanylidene-indol-1-yl]methyl-dimethyl-azanium Openeye Name: [(3Z)-3-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazono]-5-bromo-2-oxo-indolin-1-yl]methyl-dimethyl-ammonium CAS Name: [(3Z)-3-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]hydrazinylidene]-5-bromo-2-oxo-1-indolyl]methyl-dimethylammonium IUPAC Name: [(3Z)-3-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinylidene]-5-bromo-2-oxoindol-1-yl]methyl-dimethylazanium Traditional Name: [(3Z)-3-[[2-(1,3-benzoxazol-2-ylthio)acetyl]hydrazono]-5-bromo-2-keto-indolin-1-yl]methyl-dimethyl-ammonium Formula: C20H19BrN5O3S+ MolecularWeight: 489.36556

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CN1C2=C(C=C(C=C2)Br)C(=NNC(=O)CSC3=NC4=CC=CC=C4O3)C1=O

Isomeric SMILES

C[NH+](C)CN1C2=C(C=C(C=C2)Br)/C(=N/NC(=O)CSC3=NC4=CC=CC=C4O3)/C1=O

InChI

InChI=1S/C20H18BrN5O3S/c1-25(2)11-26-15-8-7-12(21)9-13(15)18(19(26)28)24-23-17(27)10-30-20-22-14-5-3-4-6-16(14)29-20/h3-9H,10-11H2,1-2H3,(H,23,27)/p+1/b24-18-