N-cyano-N'-methyl-5-[4-[[N'-[2,2,2-tris(fluoranyl)ethyl]carbamimidoyl]amino]pyrimidin-2-yl]pentanimidamide

Systemtic Name: N-cyano-N'-methyl-5-[4-[[N'-[2,2,2-tris(fluoranyl)ethyl]carbamimidoyl]amino]pyrimidin-2-yl]pentanimidamide Openeye Name: N-cyano-N'-methyl-5-[4-[[N'-(2,2,2-trifluoroethyl)carbamimidoyl]amino]pyrimidin-2-yl]pentanamidine CAS Name: 5-[4-[[amino(2,2,2-trifluoroethylimino)methyl]amino]-2-pyrimidinyl]-N-cyano-N'-methylpentanimidamide IUPAC Name: N-cyano-N'-methyl-5-[4-[[N'-(2,2,2-trifluoroethyl)carbamimidoyl]amino]pyrimidin-2-yl]pentanimidamide Traditional Name: N-cyano-N'-methyl-5-[4-[[N'-(2,2,2-trifluoroethyl)amidino]amino]pyrimidin-2-yl]valeramidine Formula: C14H19F3N8 MolecularWeight: 356.34947

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(CCCCC1=NC=CC(=N1)NC(=NCC(F)(F)F)N)NC#N

Isomeric SMILES

CN=C(CCCCC1=NC=CC(=N1)NC(=NCC(F)(F)F)N)NC#N

InChI

InChI=1S/C14H19F3N8/c1-20-10(23-9-18)4-2-3-5-11-21-7-6-12(24-11)25-13(19)22-8-14(15,16)17/h6-7H,2-5,8H2,1H3,(H,20,23)(H3,19,21,22,24,25)