N-[4-(aminomethyl)phenoxy]-N-carbamimidoyl-1-methyl-4-(trifluoromethyl)indole-2-carboxamide

Systemtic Name: N-[4-(aminomethyl)phenoxy]-N-carbamimidoyl-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Openeye Name: N-[4-(aminomethyl)phenoxy]-N-carbamimidoyl-1-methyl-4-(trifluoromethyl)indole-2-carboxamide CAS Name: N-[4-(aminomethyl)phenoxy]-N-carbamimidoyl-1-methyl-4-(trifluoromethyl)-2-indolecarboxamide IUPAC Name: N-[4-(aminomethyl)phenoxy]-N-carbamimidoyl-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Traditional Name: N-amidino-N-[4-(aminomethyl)phenoxy]-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Formula: C19H18F3N5O2 MolecularWeight: 405.37373

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2C=C1C(=O)N(C(=N)N)OC3=CC=C(C=C3)CN)C(F)(F)F

Isomeric SMILES

CN1C2=CC=CC(=C2C=C1C(=O)N(C(=N)N)OC3=CC=C(C=C3)CN)C(F)(F)F

InChI

InChI=1S/C19H18F3N5O2/c1-26-15-4-2-3-14(19(20,21)22)13(15)9-16(26)17(28)27(18(24)25)29-12-7-5-11(10-23)6-8-12/h2-9H,10,23H2,1H3,(H3,24,25)