N-[(4-bromanyl-1-ethyl-pyrazol-3-yl)methyl]-2-(1,5-dimethylpyrazol-4-yl)-N-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(4-bromanyl-1-ethyl-pyrazol-3-yl)methyl]-2-(1,5-dimethylpyrazol-4-yl)-N-methyl-quinoline-4-carboxamide Openeye Name: N-[(4-bromo-1-ethyl-pyrazol-3-yl)methyl]-2-(1,5-dimethylpyrazol-4-yl)-N-methyl-quinoline-4-carboxamide CAS Name: N-[(4-bromo-1-ethyl-3-pyrazolyl)methyl]-2-(1,5-dimethyl-4-pyrazolyl)-N-methyl-4-quinolinecarboxamide IUPAC Name: N-[(4-bromo-1-ethylpyrazol-3-yl)methyl]-2-(1,5-dimethylpyrazol-4-yl)-N-methylquinoline-4-carboxamide Traditional Name: N-[(4-bromo-1-ethyl-pyrazol-3-yl)methyl]-2-(1,5-dimethylpyrazol-4-yl)-N-methyl-cinchoninamide Formula: C22H23BrN6O MolecularWeight: 467.36162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)CN(C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C)C)Br

Isomeric SMILES

CCN1C=C(C(=N1)CN(C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C)C)Br

InChI

InChI=1S/C22H23BrN6O/c1-5-29-12-18(23)21(26-29)13-27(3)22(30)16-10-20(17-11-24-28(4)14(17)2)25-19-9-7-6-8-15(16)19/h6-12H,5,13H2,1-4H3