tert-butyl 5-[(3-bromanyl-5-chloranyl-pyridin-2-yl)-[(2-methylpropan-2-yl)oxycarbonyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 5-[(3-bromanyl-5-chloranyl-pyridin-2-yl)-[(2-methylpropan-2-yl)oxycarbonyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 5-[(3-bromo-5-chloro-2-pyridyl)-tert-butoxycarbonyl-carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 5-[[(3-bromo-5-chloro-2-pyridinyl)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-oxomethyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(3-bromo-5-chloropyridin-2-yl)-[(2-methylpropan-2-yl)oxycarbonyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 5-[(3-bromo-5-chloro-2-pyridyl)-tert-butoxycarbonyl-carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C21H27BrClN3O5 MolecularWeight: 516.81318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC=C(C1)C(=O)N(C2=C(C=C(C=N2)Cl)Br)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC=C(C1)C(=O)N(C2=C(C=C(C=N2)Cl)Br)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H27BrClN3O5/c1-20(2,3)30-18(28)25-9-7-8-13(12-25)17(27)26(19(29)31-21(4,5)6)16-15(22)10-14(23)11-24-16/h8,10-11H,7,9,12H2,1-6H3