2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(2-chloro-6-fluoro-phenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(2-chloro-6-fluoro-benzyl)-N-methyl-acetamide Formula: C14H14ClFN4O2S MolecularWeight: 356.802963

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C(=O)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C(=O)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C14H14ClFN4O2S/c1-20(6-8-9(15)3-2-4-10(8)16)13(22)7-23-14-18-11(17)5-12(21)19-14/h2-5H,6-7H2,1H3,(H3,17,18,19,21)