N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-chloranyl-ethanamide

Systemtic Name: N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-chloranyl-ethanamide Openeye Name: N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-chloro-acetamide CAS Name: N-[5-(4-tert-butylphenyl)-2-phenyl-3-pyrazolyl]-2-chloroacetamide IUPAC Name: N-[5-(4-tert-butylphenyl)-2-phenylpyrazol-3-yl]-2-chloroacetamide Traditional Name: N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-chloro-acetamide Formula: C21H22ClN3O MolecularWeight: 367.87188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CCl)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CCl)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O/c1-21(2,3)16-11-9-15(10-12-16)18-13-19(23-20(26)14-22)25(24-18)17-7-5-4-6-8-17/h4-13H,14H2,1-3H3,(H,23,26)