N-carbamimidoyl-N-[[3-(dimethylaminomethyl)phenyl]methoxy]-1-methyl-4-(trifluoromethyl)indole-2-carboxamide

Systemtic Name: N-carbamimidoyl-N-[[3-(dimethylaminomethyl)phenyl]methoxy]-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Openeye Name: N-carbamimidoyl-N-[[3-(dimethylaminomethyl)phenyl]methoxy]-1-methyl-4-(trifluoromethyl)indole-2-carboxamide CAS Name: N-carbamimidoyl-N-[[3-(dimethylaminomethyl)phenyl]methoxy]-1-methyl-4-(trifluoromethyl)-2-indolecarboxamide IUPAC Name: N-carbamimidoyl-N-[[3-(dimethylaminomethyl)phenyl]methoxy]-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Traditional Name: N-amidino-N-[3-(dimethylaminomethyl)benzyl]oxy-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Formula: C22H24F3N5O2 MolecularWeight: 447.45347

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2C=C1C(=O)N(C(=N)N)OCC3=CC=CC(=C3)CN(C)C)C(F)(F)F

Isomeric SMILES

CN1C2=CC=CC(=C2C=C1C(=O)N(C(=N)N)OCC3=CC=CC(=C3)CN(C)C)C(F)(F)F

InChI

InChI=1S/C22H24F3N5O2/c1-28(2)12-14-6-4-7-15(10-14)13-32-30(21(26)27)20(31)19-11-16-17(22(23,24)25)8-5-9-18(16)29(19)3/h4-11H,12-13H2,1-3H3,(H3,26,27)