4-(5-acetamido-3-methyl-4-phenyl-pyrazol-1-yl)-N-(2,3-dimethylphenyl)benzamide

Systemtic Name: 4-(5-acetamido-3-methyl-4-phenyl-pyrazol-1-yl)-N-(2,3-dimethylphenyl)benzamide Openeye Name: 4-(5-acetamido-3-methyl-4-phenyl-pyrazol-1-yl)-N-(2,3-dimethylphenyl)benzamide CAS Name: 4-(5-acetamido-3-methyl-4-phenyl-1-pyrazolyl)-N-(2,3-dimethylphenyl)benzamide IUPAC Name: 4-(5-acetamido-3-methyl-4-phenylpyrazol-1-yl)-N-(2,3-dimethylphenyl)benzamide Traditional Name: 4-(5-acetamido-3-methyl-4-phenyl-pyrazol-1-yl)-N-(2,3-dimethylphenyl)benzamide Formula: C27H26N4O2 MolecularWeight: 438.52094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)C4=CC=CC=C4)NC(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)C4=CC=CC=C4)NC(=O)C)C

InChI

InChI=1S/C27H26N4O2/c1-17-9-8-12-24(18(17)2)29-27(33)22-13-15-23(16-14-22)31-26(28-20(4)32)25(19(3)30-31)21-10-6-5-7-11-21/h5-16H,1-4H3,(H,28,32)(H,29,33)