tert-butyl N-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]carbamate Openeye Name: tert-butyl N-[2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-[2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-2-oxoethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-2-oxoethyl]carbamate Traditional Name: N-[2-[4-(5-bromo-2-pyridyl)piperazino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C16H23BrN4O3 MolecularWeight: 399.28282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)N1CCN(CC1)C2=NC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)N1CCN(CC1)C2=NC=C(C=C2)Br

InChI

InChI=1S/C16H23BrN4O3/c1-16(2,3)24-15(23)19-11-14(22)21-8-6-20(7-9-21)13-5-4-12(17)10-18-13/h4-5,10H,6-9,11H2,1-3H3,(H,19,23)