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

Systemtic Name: ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(4-methoxy-3-oxidanyl-phenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3-hydroxy-4-methoxy-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3-hydroxy-4-methoxyphenyl)-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-(3-hydroxy-4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3-hydroxy-4-methoxy-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O6S/c1-4-29-22(27)20-13(2)25(15-6-8-18-19(12-15)31-10-9-30-18)23(32)24-21(20)14-5-7-17(28-3)16(26)11-14/h5-8,11-12,21,26H,4,9-10H2,1-3H3,(H,24,32)