[5-bromanyl-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-2-oxidanylidene-indol-1-yl]methyl-dimethyl-azanium

Systemtic Name: [5-bromanyl-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-2-oxidanylidene-indol-1-yl]methyl-dimethyl-azanium Openeye Name: [5-bromo-3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)imino]-2-oxo-indolin-1-yl]methyl-dimethyl-ammonium CAS Name: [5-bromo-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-2-oxo-1-indolyl]methyl-dimethylammonium IUPAC Name: [5-bromo-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-2-oxoindol-1-yl]methyl-dimethylazanium Traditional Name: [5-bromo-3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)imino]-2-keto-indolin-1-yl]methyl-dimethyl-ammonium Formula: C20H20BrN4OS+ MolecularWeight: 444.368

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CN1C2=C(C=C(C=C2)Br)C(=NC3=C(C4=C(S3)CCCC4)C#N)C1=O

Isomeric SMILES

C[NH+](C)CN1C2=C(C=C(C=C2)Br)C(=NC3=C(C4=C(S3)CCCC4)C#N)C1=O

InChI

InChI=1S/C20H19BrN4OS/c1-24(2)11-25-16-8-7-12(21)9-14(16)18(20(25)26)23-19-15(10-22)13-5-3-4-6-17(13)27-19/h7-9H,3-6,11H2,1-2H3/p+1