N-butyl-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-ethyl-hexanamide

Systemtic Name: N-butyl-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-ethyl-hexanamide Openeye Name: N-butyl-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-2-ethyl-hexanamide CAS Name: N-butyl-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-2-ethylhexanamide IUPAC Name: N-butyl-N-[2-[[2-(2,4-dimethylphenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-2-ethylhexanamide Traditional Name: N-butyl-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-2-ethyl-hexanamide Formula: C31H42N4O2 MolecularWeight: 502.69078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CCCC)CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)C(=O)N(CCCC)CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3

InChI

InChI=1S/C31H42N4O2/c1-6-9-14-25(8-3)31(37)34(19-10-7-2)22-30(36)32-29-21-27(26-15-12-11-13-16-26)33-35(29)28-18-17-23(4)20-24(28)5/h11-13,15-18,20-21,25H,6-10,14,19,22H2,1-5H3,(H,32,36)