N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-2-keto-1H-quinoline-4-carboxamide Formula: C20H15BrN4O2 MolecularWeight: 423.2627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H15BrN4O2/c21-14-7-5-13(6-8-14)12-25-18(9-10-22-25)24-20(27)16-11-19(26)23-17-4-2-1-3-15(16)17/h1-11H,12H2,(H,23,26)(H,24,27)