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

Systemtic Name: 2-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(1-phenylethyl)pentanamide Openeye Name: 2-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(1-phenylethyl)pentanamide CAS Name: 2-[[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(1-phenylethyl)pentanamide IUPAC Name: 2-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(1-phenylethyl)pentanamide Traditional Name: 2-[[5-(4-fluorobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(1-phenylethyl)valeramide Formula: C26H30FN3O2S MolecularWeight: 467.598703

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(C)C1=CC=CC=C1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCCC(C(=O)NC(C)C1=CC=CC=C1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C26H30FN3O2S/c1-5-9-23(24(31)28-17(2)20-10-7-6-8-11-20)33-26-29-18(3)22(25(32)30(26)4)16-19-12-14-21(27)15-13-19/h6-8,10-15,17,23H,5,9,16H2,1-4H3,(H,28,31)