N-[6-azanyl-2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-ethoxy-benzamide

Systemtic Name: N-[6-azanyl-2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Openeye Name: N-[6-amino-2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-ethoxy-benzamide CAS Name: N-[6-amino-2-[(2-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]-4-ethoxybenzamide IUPAC Name: N-[6-amino-2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-ethoxybenzamide Traditional Name: N-[6-amino-2-[(2-fluorobenzyl)thio]-4-keto-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Formula: C20H19FN4O3S MolecularWeight: 414.453263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC3=CC=CC=C3F)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC3=CC=CC=C3F)N

InChI

InChI=1S/C20H19FN4O3S/c1-2-28-14-9-7-12(8-10-14)18(26)23-16-17(22)24-20(25-19(16)27)29-11-13-5-3-4-6-15(13)21/h3-10H,2,11H2,1H3,(H,23,26)(H3,22,24,25,27)