ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3,5-dimethoxy-4-oxidanyl-phenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3,5-dimethoxy-4-oxidanyl-phenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(4-hydroxy-3,5-dimethoxy-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(4-hydroxy-3,5-dimethoxy-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C24H26N2O7S MolecularWeight: 486.53744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC(=C(C(=C2)OC)O)OC)C3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)NC1C2=CC(=C(C(=C2)OC)O)OC)C3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C24H26N2O7S/c1-5-31-23(28)20-13(2)26(15-6-7-16-17(12-15)33-9-8-32-16)24(34)25-21(20)14-10-18(29-3)22(27)19(11-14)30-4/h6-7,10-12,21,27H,5,8-9H2,1-4H3,(H,25,34)