ethyl 6-[[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-4-(2-furyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-4-(2-furanyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-4-(furan-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]methyl]-4-(2-furyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C28H26N4O5S MolecularWeight: 530.59484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C(NC(=O)N4)C5=CC=CO5)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C(NC(=O)N4)C5=CC=CO5)C(=O)OCC

InChI

InChI=1S/C28H26N4O5S/c1-3-17-11-13-18(14-12-17)32-25(33)19-8-5-6-9-20(19)30-28(32)38-16-21-23(26(34)36-4-2)24(31-27(35)29-21)22-10-7-15-37-22/h5-15,24H,3-4,16H2,1-2H3,(H2,29,31,35)