N-(4-acetamidophenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-acetamidophenyl)-1-[(3,5-dimethylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)NC(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C21H22N4O3/c1-14-10-15(2)12-19(11-14)28-13-25-9-8-20(24-25)21(27)23-18-6-4-17(5-7-18)22-16(3)26/h4-12H,13H2,1-3H3,(H,22,26)(H,23,27)