2-azanyl-N-[2-[(4-bromanyl-2-pyridin-2-ylcarbonyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-methyl-pentanamide hydrochloride

Systemtic Name: 2-azanyl-N-[2-[(4-bromanyl-2-pyridin-2-ylcarbonyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-methyl-pentanamide hydrochloride Openeye Name: 2-amino-N-[2-[4-bromo-2-(pyridine-2-carbonyl)anilino]-2-oxo-ethyl]-4-methyl-pentanamide hydrochloride CAS Name: 2-amino-N-[2-[4-bromo-2-[oxo(2-pyridinyl)methyl]anilino]-2-oxoethyl]-4-methylpentanamide hydrochloride IUPAC Name: 2-amino-N-[2-[4-bromo-2-(pyridine-2-carbonyl)anilino]-2-oxoethyl]-4-methylpentanamide hydrochloride Traditional Name: 2-amino-N-[2-(4-bromo-2-picolinoyl-anilino)-2-keto-ethyl]-4-methyl-valeramide hydrochloride Formula: C20H24BrClN4O3 MolecularWeight: 483.78656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=N2)N.Cl

Isomeric SMILES

CC(C)CC(C(=O)NCC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=N2)N.Cl

InChI

InChI=1S/C20H23BrN4O3.ClH/c1-12(2)9-15(22)20(28)24-11-18(26)25-16-7-6-13(21)10-14(16)19(27)17-5-3-4-8-23-17;/h3-8,10,12,15H,9,11,22H2,1-2H3,(H,24,28)(H,25,26);1H