3-(3,5-dimethylphenyl)-6-(3-ethoxy-4-oxidanyl-phenyl)-4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: 3-(3,5-dimethylphenyl)-6-(3-ethoxy-4-oxidanyl-phenyl)-4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 3-(3,5-dimethylphenyl)-6-(3-ethoxy-4-hydroxy-phenyl)-4-methyl-N-(5-methylisoxazol-3-yl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 3-(3,5-dimethylphenyl)-6-(3-ethoxy-4-hydroxyphenyl)-4-methyl-N-(5-methyl-3-isoxazolyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 3-(3,5-dimethylphenyl)-6-(3-ethoxy-4-hydroxyphenyl)-4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 3-(3,5-dimethylphenyl)-6-(3-ethoxy-4-hydroxy-phenyl)-4-methyl-N-(5-methylisoxazol-3-yl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C26H28N4O4S MolecularWeight: 492.58992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=S)N2)C3=CC(=CC(=C3)C)C)C)C(=O)NC4=NOC(=C4)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=S)N2)C3=CC(=CC(=C3)C)C)C)C(=O)NC4=NOC(=C4)C)O

InChI

InChI=1S/C26H28N4O4S/c1-6-33-21-13-18(7-8-20(21)31)24-23(25(32)27-22-12-16(4)34-29-22)17(5)30(26(35)28-24)19-10-14(2)9-15(3)11-19/h7-13,24,31H,6H2,1-5H3,(H,28,35)(H,27,29,32)