N-[5-(dimethylaminomethyl)pyridin-3-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide

Systemtic Name: N-[5-(dimethylaminomethyl)pyridin-3-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide Openeye Name: N-[5-(dimethylaminomethyl)-3-pyridyl]-1-methyl-N-(N-oxocarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide CAS Name: N-[5-(dimethylaminomethyl)-3-pyridinyl]-N-[imino(nitroso)methyl]-1-methyl-4-(trifluoromethyl)-2-indolecarboxamide IUPAC Name: N-[5-(dimethylaminomethyl)pyridin-3-yl]-1-methyl-N-(N-oxocarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide Traditional Name: N-[5-(dimethylaminomethyl)-3-pyridyl]-N-(N-ketoamidino)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Formula: C20H19F3N6O2 MolecularWeight: 432.39907

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19F3N6O2/c1-27(2)11-12-7-13(10-25-9-12)29(19(24)26-31)18(30)17-8-14-15(20(21,22)23)5-4-6-16(14)28(17)3/h4-10,24H,11H2,1-3H3