2-[2-(5-chloranyl-1-methyl-3-phenyl-pyrazol-4-yl)ethyl]-N-quinolin-3-yl-benzamide

Systemtic Name: 2-[2-(5-chloranyl-1-methyl-3-phenyl-pyrazol-4-yl)ethyl]-N-quinolin-3-yl-benzamide Openeye Name: 2-[2-(5-chloro-1-methyl-3-phenyl-pyrazol-4-yl)ethyl]-N-(3-quinolyl)benzamide CAS Name: 2-[2-(5-chloro-1-methyl-3-phenyl-4-pyrazolyl)ethyl]-N-(3-quinolinyl)benzamide IUPAC Name: 2-[2-(5-chloro-1-methyl-3-phenylpyrazol-4-yl)ethyl]-N-quinolin-3-ylbenzamide Traditional Name: 2-[2-(5-chloro-1-methyl-3-phenyl-pyrazol-4-yl)ethyl]-N-(3-quinolyl)benzamide Formula: C28H23ClN4O MolecularWeight: 466.96142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)CCC3=CC=CC=C3C(=O)NC4=CC5=CC=CC=C5N=C4)Cl

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)CCC3=CC=CC=C3C(=O)NC4=CC5=CC=CC=C5N=C4)Cl

InChI

InChI=1S/C28H23ClN4O/c1-33-27(29)24(26(32-33)20-10-3-2-4-11-20)16-15-19-9-5-7-13-23(19)28(34)31-22-17-21-12-6-8-14-25(21)30-18-22/h2-14,17-18H,15-16H2,1H3,(H,31,34)