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

Systemtic Name: N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-5-[(4-iodanylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-5-[(4-iodophenoxy)methyl]furan-2-carboxamide CAS Name: N-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-5-[(4-iodophenoxy)methyl]-2-furancarboxamide IUPAC Name: N-(1-benzyl-4-chloropyrazol-3-yl)-5-[(4-iodophenoxy)methyl]furan-2-carboxamide Traditional Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-5-[(4-iodophenoxy)methyl]-2-furamide Formula: C22H17ClIN3O3 MolecularWeight: 533.74615

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClIN3O3/c23-19-13-27(12-15-4-2-1-3-5-15)26-21(19)25-22(28)20-11-10-18(30-20)14-29-17-8-6-16(24)7-9-17/h1-11,13H,12,14H2,(H,25,26,28)