4-[5-acetamido-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]-N-butan-2-yl-benzamide

Systemtic Name: 4-[5-acetamido-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]-N-butan-2-yl-benzamide Openeye Name: 4-[5-acetamido-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]-N-sec-butyl-benzamide CAS Name: 4-[5-acetamido-4-(4-chlorophenyl)-3-methyl-1-pyrazolyl]-N-butan-2-ylbenzamide IUPAC Name: 4-[5-acetamido-4-(4-chlorophenyl)-3-methylpyrazol-1-yl]-N-butan-2-ylbenzamide Traditional Name: 4-[5-acetamido-4-(4-chlorophenyl)-3-methyl-pyrazol-1-yl]-N-sec-butyl-benzamide Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C)C3=CC=C(C=C3)Cl)NC(=O)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C)C3=CC=C(C=C3)Cl)NC(=O)C

InChI

InChI=1S/C23H25ClN4O2/c1-5-14(2)25-23(30)18-8-12-20(13-9-18)28-22(26-16(4)29)21(15(3)27-28)17-6-10-19(24)11-7-17/h6-14H,5H2,1-4H3,(H,25,30)(H,26,29)