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

Systemtic Name: N-(4-tert-butylphenyl)-5-chloranyl-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(4-tert-butylphenyl)-5-chloro-3-methyl-pyrazole-4-carboxamide CAS Name: N-(4-tert-butylphenyl)-5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(4-tert-butylphenyl)-5-chloro-3-methylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(4-tert-butylphenyl)-5-chloro-3-methyl-pyrazole-4-carboxamide Formula: C22H24ClN3O MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)C(C)(C)C)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)C(C)(C)C)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H24ClN3O/c1-15-19(20(23)26(25-15)14-16-8-6-5-7-9-16)21(27)24-18-12-10-17(11-13-18)22(2,3)4/h5-13H,14H2,1-4H3,(H,24,27)