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

Systemtic Name: tert-butyl 5-[(3-bromanyl-5-methyl-pyridin-2-yl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 5-[(3-bromo-5-methyl-2-pyridyl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 5-[[(3-bromo-5-methyl-2-pyridinyl)amino]-oxomethyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(3-bromo-5-methylpyridin-2-yl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 5-[(3-bromo-5-methyl-2-pyridyl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C17H22BrN3O3 MolecularWeight: 396.27888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1)NC(=O)C2=CCCN(C2)C(=O)OC(C)(C)C)Br

Isomeric SMILES

CC1=CC(=C(N=C1)NC(=O)C2=CCCN(C2)C(=O)OC(C)(C)C)Br

InChI

InChI=1S/C17H22BrN3O3/c1-11-8-13(18)14(19-9-11)20-15(22)12-6-5-7-21(10-12)16(23)24-17(2,3)4/h6,8-9H,5,7,10H2,1-4H3,(H,19,20,22)