N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-4-methyl-benzamide

Systemtic Name: N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-4-methyl-benzamide Openeye Name: N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxo-ethyl]-4-methyl-benzamide CAS Name: N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxoethyl]-4-methylbenzamide IUPAC Name: N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxoethyl]-4-methylbenzamide Traditional Name: N-butyl-N-[2-[1-(4-chlorophenyl)-5-keto-3-phenyl-3-pyrazolin-4-yl]-2-keto-ethyl]-4-methyl-benzamide Formula: C29H28ClN3O3 MolecularWeight: 502.00392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H28ClN3O3/c1-3-4-18-32(28(35)22-12-10-20(2)11-13-22)19-25(34)26-27(21-8-6-5-7-9-21)31-33(29(26)36)24-16-14-23(30)15-17-24/h5-17,31H,3-4,18-19H2,1-2H3