6-(3-ethoxy-4-oxidanyl-phenyl)-3,4-dimethyl-N-(4-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: 6-(3-ethoxy-4-oxidanyl-phenyl)-3,4-dimethyl-N-(4-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 6-(3-ethoxy-4-hydroxy-phenyl)-3,4-dimethyl-N-(p-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 6-(3-ethoxy-4-hydroxyphenyl)-3,4-dimethyl-N-(4-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 6-(3-ethoxy-4-hydroxyphenyl)-3,4-dimethyl-N-(4-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 6-(3-ethoxy-4-hydroxy-phenyl)-3,4-dimethyl-N-(p-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=S)N2)C)C)C(=O)NC3=CC=C(C=C3)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=S)N2)C)C)C(=O)NC3=CC=C(C=C3)C)O

InChI

InChI=1S/C22H25N3O3S/c1-5-28-18-12-15(8-11-17(18)26)20-19(14(3)25(4)22(29)24-20)21(27)23-16-9-6-13(2)7-10-16/h6-12,20,26H,5H2,1-4H3,(H,23,27)(H,24,29)