tert-butyl 4-[methyl-[3-(2-methylbut-3-yn-2-ylamino)pyridin-2-yl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[methyl-[3-(2-methylbut-3-yn-2-ylamino)pyridin-2-yl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(1,1-dimethylprop-2-ynylamino)-2-pyridyl]-methyl-amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[3-(2-methylbut-3-yn-2-ylamino)-2-pyridinyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[methyl-[3-(2-methylbut-3-yn-2-ylamino)pyridin-2-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-(1,1-dimethylprop-2-ynylamino)-2-pyridyl]-methyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N(C)C2=C(C=CC=N2)NC(C)(C)C#C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N(C)C2=C(C=CC=N2)NC(C)(C)C#C

InChI

InChI=1S/C21H32N4O2/c1-8-21(5,6)23-17-10-9-13-22-18(17)24(7)16-11-14-25(15-12-16)19(26)27-20(2,3)4/h1,9-10,13,16,23H,11-12,14-15H2,2-7H3