N-(4-tert-butylphenyl)-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(4-tert-butylphenyl)-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(4-tert-butylphenyl)-5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-(4-tert-butylphenyl)-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H22ClN3O MolecularWeight: 367.87188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)C(C)(C)C)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)C(C)(C)C)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O/c1-14-18(19(22)25(24-14)17-8-6-5-7-9-17)20(26)23-16-12-10-15(11-13-16)21(2,3)4/h5-13H,1-4H3,(H,23,26)