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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)F

Isomeric SMILES

CCCCNC(=O)CC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)F

InChI

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