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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(=CN=C(C1=O)NC2CCC2)Br

Isomeric SMILES

CC(C)(C)OC(=O)CN1C(=CN=C(C1=O)NC2CCC2)Br

InChI

InChI=1S/C14H20BrN3O3/c1-14(2,3)21-11(19)8-18-10(15)7-16-12(13(18)20)17-9-5-4-6-9/h7,9H,4-6,8H2,1-3H3,(H,16,17)