ethyl 4-(3-methoxy-4-oxidanyl-phenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(3-methoxy-4-oxidanyl-phenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-hydroxy-3-methoxy-phenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate CAS Name: 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-(methylthio)-1-phenyl-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate Traditional Name: 4-(4-hydroxy-3-methoxy-phenyl)-6-methyl-2-(methylthio)-1-phenyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=NC1C2=CC(=C(C=C2)O)OC)SC)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=NC1C2=CC(=C(C=C2)O)OC)SC)C3=CC=CC=C3)C

InChI

InChI=1S/C22H24N2O4S/c1-5-28-21(26)19-14(2)24(16-9-7-6-8-10-16)22(29-4)23-20(19)15-11-12-17(25)18(13-15)27-3/h6-13,20,25H,5H2,1-4H3