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

Systemtic Name: ethyl 6-[[(4-bromophenyl)methyl-methyl-amino]methyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[(4-bromophenyl)methyl-methyl-amino]methyl]-4-(2-furyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(4-bromophenyl)methyl-methylamino]methyl]-4-(2-furanyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(4-bromophenyl)methyl-methylamino]methyl]-4-(furan-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(4-bromobenzyl)-methyl-amino]methyl]-4-(2-furyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H22BrN3O4 MolecularWeight: 448.31038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CO2)CN(C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CO2)CN(C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O4/c1-3-27-19(25)17-15(12-24(2)11-13-6-8-14(21)9-7-13)22-20(26)23-18(17)16-5-4-10-28-16/h4-10,18H,3,11-12H2,1-2H3,(H2,22,23,26)