N-[(4-bromanyl-2-methyl-pyrazol-3-yl)methyl]-2-(1-ethylpyrazol-4-yl)-N-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(4-bromanyl-2-methyl-pyrazol-3-yl)methyl]-2-(1-ethylpyrazol-4-yl)-N-methyl-quinoline-4-carboxamide Openeye Name: N-[(4-bromo-2-methyl-pyrazol-3-yl)methyl]-2-(1-ethylpyrazol-4-yl)-N-methyl-quinoline-4-carboxamide CAS Name: N-[(4-bromo-2-methyl-3-pyrazolyl)methyl]-2-(1-ethyl-4-pyrazolyl)-N-methyl-4-quinolinecarboxamide IUPAC Name: N-[(4-bromo-2-methylpyrazol-3-yl)methyl]-2-(1-ethylpyrazol-4-yl)-N-methylquinoline-4-carboxamide Traditional Name: N-[(4-bromo-2-methyl-pyrazol-3-yl)methyl]-2-(1-ethylpyrazol-4-yl)-N-methyl-cinchoninamide Formula: C21H21BrN6O MolecularWeight: 453.33504

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N(C)CC4=C(C=NN4C)Br

Isomeric SMILES

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N(C)CC4=C(C=NN4C)Br

InChI

InChI=1S/C21H21BrN6O/c1-4-28-12-14(10-24-28)19-9-16(15-7-5-6-8-18(15)25-19)21(29)26(2)13-20-17(22)11-23-27(20)3/h5-12H,4,13H2,1-3H3