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

Systemtic Name: N-[6-azanyl-2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]furan-2-carboxamide Openeye Name: N-[6-amino-2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide CAS Name: N-[6-amino-2-[(2-chloro-6-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]-2-furancarboxamide IUPAC Name: N-[6-amino-2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide Traditional Name: N-[6-amino-2-[(2-chloro-6-fluoro-benzyl)thio]-4-keto-1H-pyrimidin-5-yl]-2-furamide Formula: C16H12ClFN4O3S MolecularWeight: 394.807883

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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=CO3)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=CO3)F

InChI

InChI=1S/C16H12ClFN4O3S/c17-9-3-1-4-10(18)8(9)7-26-16-21-13(19)12(15(24)22-16)20-14(23)11-5-2-6-25-11/h1-6H,7H2,(H,20,23)(H3,19,21,22,24)