N-[6-acetamido-2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[6-acetamido-2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-fluoranyl-benzamide Openeye Name: N-[6-acetamido-2-(2-amino-2-oxo-ethyl)sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-fluoro-benzamide CAS Name: N-[6-acetamido-2-[(2-amino-2-oxoethyl)thio]-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide IUPAC Name: N-[6-acetamido-2-(2-amino-2-oxoethyl)sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide Traditional Name: N-[6-acetamido-2-[(2-amino-2-keto-ethyl)thio]-4-keto-1H-pyrimidin-5-yl]-4-fluoro-benzamide Formula: C15H14FN5O4S MolecularWeight: 379.366163

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=O)N=C(N1)SCC(=O)N)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)NC1=C(C(=O)N=C(N1)SCC(=O)N)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C15H14FN5O4S/c1-7(22)18-12-11(14(25)21-15(20-12)26-6-10(17)23)19-13(24)8-2-4-9(16)5-3-8/h2-5H,6H2,1H3,(H2,17,23)(H,19,24)(H2,18,20,21,22,25)