5-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(4-methylphenyl)pentanamide

Systemtic Name: 5-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(4-methylphenyl)pentanamide Openeye Name: 5-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(p-tolyl)pentanamide CAS Name: 5-[[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(4-methylphenyl)pentanamide IUPAC Name: 5-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(4-methylphenyl)pentanamide Traditional Name: 5-[[5-(4-fluorobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(p-tolyl)valeramide Formula: C25H28FN3O2S MolecularWeight: 453.572123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCCCSC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCCCSC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C25H28FN3O2S/c1-17-7-13-21(14-8-17)28-23(30)6-4-5-15-32-25-27-18(2)22(24(31)29(25)3)16-19-9-11-20(26)12-10-19/h7-14H,4-6,15-16H2,1-3H3,(H,28,30)