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

Systemtic Name: N-[6-acetamido-2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[6-acetamido-2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]benzamide CAS Name: N-[6-acetamido-2-[(4-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[6-acetamido-2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[6-acetamido-2-[(4-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=C(C=C2)F)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)NC(=O)C3=CC=CC=C3

InChI

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