N-carbamimidoyl-N-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide dihydrochloride

Systemtic Name: N-carbamimidoyl-N-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide dihydrochloride Openeye Name: N-carbamimidoyl-N-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide dihydrochloride CAS Name: N-carbamimidoyl-N-[2-(1-imidazolyl)ethoxy]-1-methyl-4-(trifluoromethyl)-2-indolecarboxamide dihydrochloride IUPAC Name: N-carbamimidoyl-N-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide dihydrochloride Traditional Name: N-amidino-N-(2-imidazol-1-ylethoxy)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide dihydrochloride Formula: C17H19Cl2F3N6O2 MolecularWeight: 467.27297

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2C=C1C(=O)N(C(=N)N)OCCN3C=CN=C3)C(F)(F)F.Cl.Cl

Isomeric SMILES

CN1C2=CC=CC(=C2C=C1C(=O)N(C(=N)N)OCCN3C=CN=C3)C(F)(F)F.Cl.Cl

InChI

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