tert-butyl 3-(2-methylbut-3-yn-2-ylamino)-4-pyridin-2-yl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 3-(2-methylbut-3-yn-2-ylamino)-4-pyridin-2-yl-piperazine-1-carboxylate Openeye Name: tert-butyl 3-(1,1-dimethylprop-2-ynylamino)-4-(2-pyridyl)piperazine-1-carboxylate CAS Name: 3-(2-methylbut-3-yn-2-ylamino)-4-(2-pyridinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-methylbut-3-yn-2-ylamino)-4-pyridin-2-ylpiperazine-1-carboxylate Traditional Name: 3-(1,1-dimethylprop-2-ynylamino)-4-(2-pyridyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H28N4O2 MolecularWeight: 344.45122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(C1)NC(C)(C)C#C)C2=CC=CC=N2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(C1)NC(C)(C)C#C)C2=CC=CC=N2

InChI

InChI=1S/C19H28N4O2/c1-7-19(5,6)21-16-14-22(17(24)25-18(2,3)4)12-13-23(16)15-10-8-9-11-20-15/h1,8-11,16,21H,12-14H2,2-6H3