ethyl 6-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[(4-ethoxyphenyl)methyl-methyl-amino]methyl]-4-(2-furyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(4-ethoxyphenyl)methyl-methylamino]methyl]-4-(2-furanyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(4-ethoxyphenyl)methyl-methylamino]methyl]-4-(furan-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(4-ethoxybenzyl)-methyl-amino]methyl]-4-(2-furyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(C)CC2=C(C(NC(=O)N2)C3=CC=CO3)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(C)CC2=C(C(NC(=O)N2)C3=CC=CO3)C(=O)OCC

InChI

InChI=1S/C22H27N3O5/c1-4-28-16-10-8-15(9-11-16)13-25(3)14-17-19(21(26)29-5-2)20(24-22(27)23-17)18-7-6-12-30-18/h6-12,20H,4-5,13-14H2,1-3H3,(H2,23,24,27)