N-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]octanamide

Systemtic Name: N-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]octanamide Openeye Name: N-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]octanamide CAS Name: N-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]octanamide IUPAC Name: N-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]octanamide Traditional Name: N-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]caprylamide Formula: C29H37ClN4O2 MolecularWeight: 509.08268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CCCC)CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC(=O)N(CCCC)CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3

InChI

InChI=1S/C29H37ClN4O2/c1-3-5-7-8-12-19-29(36)33(20-6-4-2)22-28(35)31-27-21-25(23-15-10-9-11-16-23)32-34(27)26-18-14-13-17-24(26)30/h9-11,13-18,21H,3-8,12,19-20,22H2,1-2H3,(H,31,35)