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

Systemtic Name: ethyl 4-[5-bromanyl-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-[2-(benzylamino)-2-oxo-ethoxy]-5-bromo-phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[5-bromo-2-[2-oxo-2-[(phenylmethyl)amino]ethoxy]phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-(benzylamino)-2-oxoethoxy]-5-bromophenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[2-[2-(benzylamino)-2-keto-ethoxy]-5-bromo-phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H24BrN3O5 MolecularWeight: 502.35776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=C(C=CC(=C2)Br)OCC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=C(C=CC(=C2)Br)OCC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C23H24BrN3O5/c1-3-31-22(29)20-14(2)26-23(30)27-21(20)17-11-16(24)9-10-18(17)32-13-19(28)25-12-15-7-5-4-6-8-15/h4-11,21H,3,12-13H2,1-2H3,(H,25,28)(H2,26,27,30)