1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methylquinolin-4-yl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methylquinolin-4-yl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-quinolyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(2-methyl-4-quinolinyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-methylquinolin-4-yl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-methyl-4-quinolyl)pyrazole-3-carboxamide Formula: C20H19BrN6O MolecularWeight: 439.30846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C20H19BrN6O/c1-12-10-18(15-6-4-5-7-16(15)22-12)23-20(28)17-8-9-26(25-17)11-27-14(3)19(21)13(2)24-27/h4-10H,11H2,1-3H3,(H,22,23,28)