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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NCCC1=CC=CC=C1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCCCC(C(=O)NCCC1=CC=CC=C1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C27H32FN3O2S/c1-4-5-11-24(25(32)29-17-16-20-9-7-6-8-10-20)34-27-30-19(2)23(26(33)31(27)3)18-21-12-14-22(28)15-13-21/h6-10,12-15,24H,4-5,11,16-18H2,1-3H3,(H,29,32)