2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(3-methylbutyl)ethanamide Openeye Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-isopentyl-acetamide CAS Name: 2-[2-[(4-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(3-methylbutyl)acetamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-isoamyl-acetamide Formula: C18H22FN3O2S MolecularWeight: 363.449583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FN3O2S/c1-12(2)7-8-20-16(23)9-15-10-17(24)22-18(21-15)25-11-13-3-5-14(19)6-4-13/h3-6,10,12H,7-9,11H2,1-2H3,(H,20,23)(H,21,22,24)