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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CCCC)CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)C(=O)N(CCCC)CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3

InChI

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