N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(2,4-dimethylquinolin-3-yl)ethanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(2,4-dimethylquinolin-3-yl)ethanamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(2,4-dimethyl-3-quinolyl)acetamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-2-(2,4-dimethyl-3-quinolinyl)acetamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(2,4-dimethylquinolin-3-yl)acetamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-2-(2,4-dimethyl-3-quinolyl)acetamide Formula: C23H21BrN4O MolecularWeight: 449.34304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H21BrN4O/c1-15-19-5-3-4-6-21(19)26-16(2)20(15)13-23(29)27-22-11-12-25-28(22)14-17-7-9-18(24)10-8-17/h3-12H,13-14H2,1-2H3,(H,27,29)