ethyl 4-(4-methoxyphenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate CAS Name: 4-(4-methoxyphenyl)-6-methyl-2-(methylthio)-1-phenyl-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-6-methyl-2-methylsulfanyl-1-phenyl-4H-pyrimidine-5-carboxylate Traditional Name: 4-(4-methoxyphenyl)-6-methyl-2-(methylthio)-1-phenyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3S/c1-5-27-21(25)19-15(2)24(17-9-7-6-8-10-17)22(28-4)23-20(19)16-11-13-18(26-3)14-12-16/h6-14,20H,5H2,1-4H3