tert-butyl 4-[3-chloranyl-5-(methylcarbamoyl)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-chloranyl-5-(methylcarbamoyl)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-chloro-5-(methylcarbamoyl)-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[3-chloro-5-(methylcarbamoyl)-2-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-chloro-5-(methylcarbamoyl)pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-chloro-5-(methylcarbamoyl)-2-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C16H23ClN4O3 MolecularWeight: 354.83182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C=N2)C(=O)NC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C=N2)C(=O)NC)Cl

InChI

InChI=1S/C16H23ClN4O3/c1-16(2,3)24-15(23)21-7-5-20(6-8-21)13-12(17)9-11(10-19-13)14(22)18-4/h9-10H,5-8H2,1-4H3,(H,18,22)