2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-propyl-ethanamide

Systemtic Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-propyl-ethanamide Openeye Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-propyl-acetamide CAS Name: 2-[2-[(4-fluorophenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-propylacetamide IUPAC Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-propylacetamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-propyl-acetamide Formula: C17H20FN3O2S MolecularWeight: 349.423003

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CC1=C(NC(=NC1=O)SCC2=CC=C(C=C2)F)C

Isomeric SMILES

CCCNC(=O)CC1=C(NC(=NC1=O)SCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H20FN3O2S/c1-3-8-19-15(22)9-14-11(2)20-17(21-16(14)23)24-10-12-4-6-13(18)7-5-12/h4-7H,3,8-10H2,1-2H3,(H,19,22)(H,20,21,23)