N-[bis(azanyl)methylidene]-7-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-7-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Openeye Name: N-(diaminomethylene)-7-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide CAS Name: N-(diaminomethylidene)-7-[2-(1-imidazolyl)ethoxy]-1-methyl-4-(trifluoromethyl)-2-indolecarboxamide IUPAC Name: N-(diaminomethylidene)-7-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Traditional Name: N-(diaminomethylene)-7-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Formula: C17H17F3N6O2 MolecularWeight: 394.35109

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C=CC(=C21)OCCN3C=CN=C3)C(F)(F)F)C(=O)N=C(N)N

Isomeric SMILES

CN1C(=CC2=C(C=CC(=C21)OCCN3C=CN=C3)C(F)(F)F)C(=O)N=C(N)N

InChI

InChI=1S/C17H17F3N6O2/c1-25-12(15(27)24-16(21)22)8-10-11(17(18,19)20)2-3-13(14(10)25)28-7-6-26-5-4-23-9-26/h2-5,8-9H,6-7H2,1H3,(H4,21,22,24,27)