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

Systemtic Name: ethyl 6-[[(4-bromophenyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(4-bromoanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(4-bromoanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-bromoanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(4-bromoanilino)methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H16BrN3O3 MolecularWeight: 354.19914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CNC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CNC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H16BrN3O3/c1-2-21-13(19)11-7-17-14(20)18-12(11)8-16-10-5-3-9(15)4-6-10/h3-6,16H,2,7-8H2,1H3,(H2,17,18,20)