N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-[(4-iodanylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-[(4-iodanylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-[(4-iodophenoxy)methyl]furan-2-carboxamide CAS Name: N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-5-[(4-iodophenoxy)methyl]-2-furancarboxamide IUPAC Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-5-[(4-iodophenoxy)methyl]furan-2-carboxamide Traditional Name: N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-5-[(4-iodophenoxy)methyl]-2-furamide Formula: C26H26IN3O5 MolecularWeight: 587.40621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=CC=C(O3)COC4=CC=C(C=C4)I)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=CC=C(O3)COC4=CC=C(C=C4)I)OCC

InChI

InChI=1S/C26H26IN3O5/c1-3-32-23-11-5-18(13-25(23)33-4-2)15-30-16-20(14-28-30)29-26(31)24-12-10-22(35-24)17-34-21-8-6-19(27)7-9-21/h5-14,16H,3-4,15,17H2,1-2H3,(H,29,31)