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

Systemtic Name: ethyl 6-[[[5-(4-bromophenyl)furan-2-yl]methyl-methyl-amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[[5-(4-bromophenyl)-2-furyl]methyl-methyl-amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[5-(4-bromophenyl)-2-furanyl]methyl-methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[[5-(4-bromophenyl)furan-2-yl]methyl-methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[[5-(4-bromophenyl)-2-furyl]methyl-methyl-amino]methyl]-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)NC1)CN(C)CC2=CC=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CN(C)CC2=CC=C(O2)C3=CC=C(C=C3)Br

InChI

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