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

Systemtic Name: N-butan-2-yl-2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide Openeye Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[2-[(4-fluorophenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-butan-2-yl-2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-sec-butyl-acetamide Formula: C18H22FN3O2S MolecularWeight: 363.449583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FN3O2S/c1-4-11(2)20-16(23)9-15-12(3)21-18(22-17(15)24)25-10-13-5-7-14(19)8-6-13/h5-8,11H,4,9-10H2,1-3H3,(H,20,23)(H,21,22,24)