2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-6-methyl-5-p-anisyl-pyrimidin-4-olate Formula: C23H23N2O4S- MolecularWeight: 423.50472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC2=C(C=CC(=C2)C(=O)C)OC)[O-])CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC2=C(C=CC(=C2)C(=O)C)OC)[O-])CC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H24N2O4S/c1-14-20(11-16-5-8-19(28-3)9-6-16)22(27)25-23(24-14)30-13-18-12-17(15(2)26)7-10-21(18)29-4/h5-10,12H,11,13H2,1-4H3,(H,24,25,27)/p-1