tert-butyl 2-[5-bromanyl-2-(4-dimethylaminophenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[5-bromanyl-2-(4-dimethylaminophenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanoate Openeye Name: tert-butyl 2-[5-bromo-2-(4-dimethylaminophenyl)-6-oxo-pyrimidin-1-yl]acetate CAS Name: 2-[5-bromo-2-(4-dimethylaminophenyl)-6-oxo-1-pyrimidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-bromo-2-(4-dimethylaminophenyl)-6-oxopyrimidin-1-yl]acetate Traditional Name: 2-[5-bromo-2-(4-dimethylaminophenyl)-6-keto-pyrimidin-1-yl]acetic acid tert-butyl ester Formula: C18H22BrN3O3 MolecularWeight: 408.28958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(=NC=C(C1=O)Br)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)CN1C(=NC=C(C1=O)Br)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C18H22BrN3O3/c1-18(2,3)25-15(23)11-22-16(20-10-14(19)17(22)24)12-6-8-13(9-7-12)21(4)5/h6-10H,11H2,1-5H3