5-(4-chlorophenyl)-2-[5-cyano-3-(ethylcarbamoyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidin-4-yl]furan-3-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)-2-[5-cyano-3-(ethylcarbamoyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidin-4-yl]furan-3-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-2-[5-cyano-3-(ethylcarbamoyl)-6-methyl-2-oxo-1,4-dihydropyrimidin-4-yl]furan-3-carboxylic acid CAS Name: 5-(4-chlorophenyl)-2-[5-cyano-3-(ethylcarbamoyl)-6-methyl-2-oxo-1,4-dihydropyrimidin-4-yl]-3-furancarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-2-[5-cyano-3-(ethylcarbamoyl)-6-methyl-2-oxo-1,4-dihydropyrimidin-4-yl]furan-3-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-2-[5-cyano-3-(ethylcarbamoyl)-2-keto-6-methyl-1,4-dihydropyrimidin-4-yl]-3-furoic acid Formula: C20H17ClN4O5 MolecularWeight: 428.82578

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(C(=C(NC1=O)C)C#N)C2=C(C=C(O2)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCNC(=O)N1C(C(=C(NC1=O)C)C#N)C2=C(C=C(O2)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C20H17ClN4O5/c1-3-23-19(28)25-16(14(9-22)10(2)24-20(25)29)17-13(18(26)27)8-15(30-17)11-4-6-12(21)7-5-11/h4-8,16H,3H2,1-2H3,(H,23,28)(H,24,29)(H,26,27)