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

Systemtic Name: ethyl 6-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(3-chloro-4-hydroxy-5-methoxy-phenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-chloro-4-hydroxy-5-methoxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-chloro-4-hydroxy-5-methoxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-chloro-4-hydroxy-5-methoxy-phenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H23ClN2O6S MolecularWeight: 490.95652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN2O6S/c1-4-30-22(28)19-12(2)26(14-5-6-16-17(11-14)32-8-7-31-16)23(33)25-20(19)13-9-15(24)21(27)18(10-13)29-3/h5-6,9-11,20,27H,4,7-8H2,1-3H3,(H,25,33)