5-(5-bromanyl-2-oxidanylidene-indol-3-yl)-2-[[3-(trifluoromethyl)phenyl]amino]-1,3-thiazol-4-olate

Systemtic Name: 5-(5-bromanyl-2-oxidanylidene-indol-3-yl)-2-[[3-(trifluoromethyl)phenyl]amino]-1,3-thiazol-4-olate Openeye Name: 5-(5-bromo-2-oxo-indol-3-yl)-2-[3-(trifluoromethyl)anilino]thiazol-4-olate CAS Name: 5-(5-bromo-2-oxo-3-indolyl)-2-[3-(trifluoromethyl)anilino]-4-thiazololate IUPAC Name: 5-(5-bromo-2-oxoindol-3-yl)-2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-olate Traditional Name: 5-(5-bromo-2-keto-indol-3-yl)-2-[3-(trifluoromethyl)anilino]thiazol-4-olate Formula: C18H8BrF3N3O2S- MolecularWeight: 467.23923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=C(S2)C3=C4C=C(C=CC4=NC3=O)Br)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=C(S2)C3=C4C=C(C=CC4=NC3=O)Br)[O-])C(F)(F)F

InChI

InChI=1S/C18H9BrF3N3O2S/c19-9-4-5-12-11(7-9)13(15(26)24-12)14-16(27)25-17(28-14)23-10-3-1-2-8(6-10)18(20,21)22/h1-7,27H,(H,23,25)/p-1