tert-butyl 2-[2-bromanyl-5-(cyclobutylamino)-6-oxidanylidene-1H-pyrazin-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[2-bromanyl-5-(cyclobutylamino)-6-oxidanylidene-1H-pyrazin-3-yl]ethanoate Openeye Name: tert-butyl 2-[2-bromo-5-(cyclobutylamino)-6-oxo-1H-pyrazin-3-yl]acetate CAS Name: 2-[2-bromo-5-(cyclobutylamino)-6-oxo-1H-pyrazin-3-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-bromo-5-(cyclobutylamino)-6-oxo-1H-pyrazin-3-yl]acetate Traditional Name: 2-[2-bromo-5-(cyclobutylamino)-6-keto-1H-pyrazin-3-yl]acetic acid tert-butyl ester Formula: C14H20BrN3O3 MolecularWeight: 358.2309

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1=C(NC(=O)C(=N1)NC2CCC2)Br

Isomeric SMILES

CC(C)(C)OC(=O)CC1=C(NC(=O)C(=N1)NC2CCC2)Br

InChI

InChI=1S/C14H20BrN3O3/c1-14(2,3)21-10(19)7-9-11(15)18-13(20)12(17-9)16-8-5-4-6-8/h8H,4-7H2,1-3H3,(H,16,17)(H,18,20)