N-[bis(azanyl)methylidene]-1-methyl-7-oxidanyl-4-(trifluoromethyl)indole-2-carboxamide; methanesulfonic acid

Systemtic Name: N-[bis(azanyl)methylidene]-1-methyl-7-oxidanyl-4-(trifluoromethyl)indole-2-carboxamide; methanesulfonic acid Openeye Name: N-(diaminomethylene)-7-hydroxy-1-methyl-4-(trifluoromethyl)indole-2-carboxamide; methanesulfonic acid CAS Name: N-(diaminomethylidene)-7-hydroxy-1-methyl-4-(trifluoromethyl)-2-indolecarboxamide; methanesulfonic acid IUPAC Name: N-(diaminomethylidene)-7-hydroxy-1-methyl-4-(trifluoromethyl)indole-2-carboxamide; methanesulfonic acid Traditional Name: N-(diaminomethylene)-7-hydroxy-1-methyl-4-(trifluoromethyl)indole-2-carboxamide; mesylic acid Formula: C13H15F3N4O5S MolecularWeight: 396.34221

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C=CC(=C21)O)C(F)(F)F)C(=O)N=C(N)N.CS(=O)(=O)O

Isomeric SMILES

CN1C(=CC2=C(C=CC(=C21)O)C(F)(F)F)C(=O)N=C(N)N.CS(=O)(=O)O

InChI

InChI=1S/C12H11F3N4O2.CH4O3S/c1-19-7(10(21)18-11(16)17)4-5-6(12(13,14)15)2-3-8(20)9(5)19;1-5(2,3)4/h2-4,20H,1H3,(H4,16,17,18,21);1H3,(H,2,3,4)