methyl 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-oxidanylidene-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-oxidanylidene-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 2-[4-(furan-2-carbonyl)piperazin-1-yl]-6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-(furan-2-carbonyl)piperazin-1-yl]-6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-[4-(2-furoyl)piperazino]-6-keto-4-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C(=O)C3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C(=O)C3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O5/c1-29-20(28)16-17(14-6-3-2-4-7-14)22-21(23-18(16)26)25-11-9-24(10-12-25)19(27)15-8-5-13-30-15/h2-8,13,16-17H,9-12H2,1H3,(H,22,23,26)