N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-7,8-dimethyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-7,8-dimethyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-7,8-dimethyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-7,8-dimethyl-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-7,8-dimethyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)pyrazol-4-yl]-7,8-dimethyl-2-(2-pyridyl)cinchoninamide Formula: C27H22ClN5O MolecularWeight: 467.94948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=CN(N=C4)CC5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=CN(N=C4)CC5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C27H22ClN5O/c1-17-6-11-22-23(13-25(32-26(22)18(17)2)24-5-3-4-12-29-24)27(34)31-21-14-30-33(16-21)15-19-7-9-20(28)10-8-19/h3-14,16H,15H2,1-2H3,(H,31,34)