N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-3-(phenoxymethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-3-(phenoxymethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-3-(phenoxymethyl)benzofuran-2-carboxamide CAS Name: N-[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]-3-(phenoxymethyl)-2-benzofurancarboxamide IUPAC Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-3-(phenoxymethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-3-(phenoxymethyl)coumarilamide Formula: C28H25N3O3 MolecularWeight: 451.5164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5)C

InChI

InChI=1S/C28H25N3O3/c1-18-13-15-21(16-14-18)31-20(3)26(19(2)30-31)29-28(32)27-24(17-33-22-9-5-4-6-10-22)23-11-7-8-12-25(23)34-27/h4-16H,17H2,1-3H3,(H,29,32)