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

Systemtic Name: N-[6-acetamido-2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[6-acetamido-2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]benzamide CAS Name: N-[6-acetamido-2-[(2-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[6-acetamido-2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[6-acetamido-2-[(2-fluorobenzyl)thio]-4-keto-1H-pyrimidin-5-yl]benzamide Formula: C20H17FN4O3S MolecularWeight: 412.437383

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2F)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2F)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H17FN4O3S/c1-12(26)22-17-16(23-18(27)13-7-3-2-4-8-13)19(28)25-20(24-17)29-11-14-9-5-6-10-15(14)21/h2-10H,11H2,1H3,(H,23,27)(H2,22,24,25,26,28)