N-(4-ethoxyphenyl)-2-[2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetamide CAS Name: N-(4-ethoxyphenyl)-2-[2-[(2-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetamide Traditional Name: 2-[2-[(2-fluorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-p-phenetyl-acetamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC=CC=C3F

InChI

InChI=1S/C21H20FN3O3S/c1-2-28-17-9-7-15(8-10-17)23-19(26)11-16-12-20(27)25-21(24-16)29-13-14-5-3-4-6-18(14)22/h3-10,12H,2,11,13H2,1H3,(H,23,26)(H,24,25,27)