2,2,2-tris(fluoranyl)-N-[N'-(2-methylbutan-2-yl)-N-pyridin-3-yl-carbamimidoyl]ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-[N'-(2-methylbutan-2-yl)-N-pyridin-3-yl-carbamimidoyl]ethanamide Openeye Name: N-[N'-(1,1-dimethylpropyl)-N-(3-pyridyl)carbamimidoyl]-2,2,2-trifluoro-acetamide CAS Name: 2,2,2-trifluoro-N-[2-methylbutan-2-ylimino-(3-pyridinylamino)methyl]acetamide IUPAC Name: 2,2,2-trifluoro-N-[N'-(2-methylbutan-2-yl)-N-pyridin-3-ylcarbamimidoyl]acetamide Traditional Name: N-[N'-tert-amyl-N-(3-pyridyl)amidino]-2,2,2-trifluoro-acetamide Formula: C13H17F3N4O MolecularWeight: 302.29549

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N=C(NC1=CN=CC=C1)NC(=O)C(F)(F)F

Isomeric SMILES

CCC(C)(C)N=C(NC1=CN=CC=C1)NC(=O)C(F)(F)F

InChI

InChI=1S/C13H17F3N4O/c1-4-12(2,3)20-11(19-10(21)13(14,15)16)18-9-6-5-7-17-8-9/h5-8H,4H2,1-3H3,(H2,18,19,20,21)