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

Systemtic Name: N-butyl-2-chloranyl-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-phenyl-ethanamide Openeye Name: N-butyl-2-chloro-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-2-phenyl-acetamide CAS Name: N-butyl-2-chloro-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-2-phenylacetamide IUPAC Name: N-butyl-2-chloro-N-[2-[[2-(2,4-dimethylphenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-2-phenylacetamide Traditional Name: N-butyl-2-chloro-N-[2-[[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-2-phenyl-acetamide Formula: C31H33ClN4O2 MolecularWeight: 529.07232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3)C(=O)C(C4=CC=CC=C4)Cl

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3)C(=O)C(C4=CC=CC=C4)Cl

InChI

InChI=1S/C31H33ClN4O2/c1-4-5-18-35(31(38)30(32)25-14-10-7-11-15-25)21-29(37)33-28-20-26(24-12-8-6-9-13-24)34-36(28)27-17-16-22(2)19-23(27)3/h6-17,19-20,30H,4-5,18,21H2,1-3H3,(H,33,37)