tert-butyl 3-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[(4,5-dicyano-1H-imidazol-2-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C16H20N6O3 MolecularWeight: 344.3684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC2=NC(=C(N2)C#N)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NC2=NC(=C(N2)C#N)C#N

InChI

InChI=1S/C16H20N6O3/c1-16(2,3)25-15(24)22-6-4-5-10(9-22)13(23)21-14-19-11(7-17)12(8-18)20-14/h10H,4-6,9H2,1-3H3,(H2,19,20,21,23)