N'-[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]-N-phenethyl-butanediamide

Systemtic Name: N'-[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]-N-phenethyl-butanediamide Openeye Name: N'-[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]-N-phenethyl-butanediamide CAS Name: N'-[2-(4-chlorophenyl)-5-methyl-4-phenyl-3-pyrazolyl]-N-phenethylbutanediamide IUPAC Name: N'-[2-(4-chlorophenyl)-5-methyl-4-phenylpyrazol-3-yl]-N-phenethylbutanediamide Traditional Name: N'-[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]-N-phenethyl-succinamide Formula: C28H27ClN4O2 MolecularWeight: 486.99258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CCC(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CCC(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H27ClN4O2/c1-20-27(22-10-6-3-7-11-22)28(33(32-20)24-14-12-23(29)13-15-24)31-26(35)17-16-25(34)30-19-18-21-8-4-2-5-9-21/h2-15H,16-19H2,1H3,(H,30,34)(H,31,35)