ethyl 3-(1,3-benzoxazol-5-ylcarbonylamino)-4-(furan-2-yl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(1,3-benzoxazol-5-ylcarbonylamino)-4-(furan-2-yl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(1,3-benzoxazole-5-carbonylamino)-4-(2-furyl)-6-methyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-[[1,3-benzoxazol-5-yl(oxo)methyl]amino]-4-(2-furanyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzoxazole-5-carbonylamino)-4-(furan-2-yl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-(1,3-benzoxazole-5-carbonylamino)-4-(2-furyl)-6-methyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C20H18N4O5S MolecularWeight: 426.44572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)N(C1C2=CC=CO2)NC(=O)C3=CC4=C(C=C3)OC=N4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)N(C1C2=CC=CO2)NC(=O)C3=CC4=C(C=C3)OC=N4)C

InChI

InChI=1S/C20H18N4O5S/c1-3-27-19(26)16-11(2)22-20(30)24(17(16)15-5-4-8-28-15)23-18(25)12-6-7-14-13(9-12)21-10-29-14/h4-10,17H,3H2,1-2H3,(H,22,30)(H,23,25)