2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(2-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[(2-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(2-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(2-fluorobenzyl)-N-methyl-acetamide Formula: C14H16FN5OS MolecularWeight: 321.373143

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1F)C(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CN(CC1=CC=CC=C1F)C(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C14H16FN5OS/c1-20(7-9-4-2-3-5-10(9)15)13(21)8-22-14-18-11(16)6-12(17)19-14/h2-6H,7-8H2,1H3,(H4,16,17,18,19)