3-(3,4-dimethylphenyl)-N-[3-(hydroxymethyl)phenyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 3-(3,4-dimethylphenyl)-N-[3-(hydroxymethyl)phenyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(3,4-dimethylphenyl)-N-[3-(hydroxymethyl)phenyl]pyrazole-4-carboxamide CAS Name: 3-(3,4-dimethylphenyl)-N-[3-(hydroxymethyl)phenyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(3,4-dimethylphenyl)-N-[3-(hydroxymethyl)phenyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(3,4-dimethylphenyl)-N-(3-methylolphenyl)pyrazole-4-carboxamide Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=CC(=C3)CO)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=CC(=C3)CO)CC4=CC=CC=C4)C

InChI

InChI=1S/C26H25N3O2/c1-18-11-12-22(13-19(18)2)25-24(16-29(28-25)15-20-7-4-3-5-8-20)26(31)27-23-10-6-9-21(14-23)17-30/h3-14,16,30H,15,17H2,1-2H3,(H,27,31)