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

Systemtic Name: ethyl 6-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(5-bromo-2-thiophenyl)methyl-methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H18BrN3O3S MolecularWeight: 388.28002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CN(C)CC2=CC=C(S2)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CN(C)CC2=CC=C(S2)Br

InChI

InChI=1S/C14H18BrN3O3S/c1-3-21-13(19)10-6-16-14(20)17-11(10)8-18(2)7-9-4-5-12(15)22-9/h4-5H,3,6-8H2,1-2H3,(H2,16,17,20)