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

Systemtic Name: 2-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(1-phenylethyl)hexanamide Openeye Name: 2-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(1-phenylethyl)hexanamide CAS Name: 2-[[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(1-phenylethyl)hexanamide IUPAC Name: 2-[5-[(4-fluorophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(1-phenylethyl)hexanamide Traditional Name: 2-[[5-(4-fluorobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(1-phenylethyl)hexanamide Formula: C27H32FN3O2S MolecularWeight: 481.625283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32FN3O2S/c1-5-6-12-24(25(32)29-18(2)21-10-8-7-9-11-21)34-27-30-19(3)23(26(33)31(27)4)17-20-13-15-22(28)16-14-20/h7-11,13-16,18,24H,5-6,12,17H2,1-4H3,(H,29,32)