N-[6-azanyl-2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[6-azanyl-2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-fluoranyl-benzamide Openeye Name: N-[6-amino-2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-fluoro-benzamide CAS Name: N-[6-amino-2-[(2-chloro-6-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide IUPAC Name: N-[6-amino-2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide Traditional Name: N-[6-amino-2-[(2-chloro-6-fluoro-benzyl)thio]-4-keto-1H-pyrimidin-5-yl]-4-fluoro-benzamide Formula: C18H13ClF2N4O2S MolecularWeight: 422.836226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)F)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)F)F

InChI

InChI=1S/C18H13ClF2N4O2S/c19-12-2-1-3-13(21)11(12)8-28-18-24-15(22)14(17(27)25-18)23-16(26)9-4-6-10(20)7-5-9/h1-7H,8H2,(H,23,26)(H3,22,24,25,27)