N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-1-(1-pyrazolylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Formula: C21H16ClN5O2 MolecularWeight: 405.83704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC(=O)C3=NN(C=C3)CN4C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC(=O)C3=NN(C=C3)CN4C=CC=N4

InChI

InChI=1S/C21H16ClN5O2/c22-16-7-8-18(17(13-16)20(28)15-5-2-1-3-6-15)24-21(29)19-9-12-27(25-19)14-26-11-4-10-23-26/h1-13H,14H2,(H,24,29)