(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-iodanylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-iodanylphenyl)prop-2-enamide Openeye Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-iodophenyl)prop-2-enamide CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(2-iodophenyl)-2-propenamide IUPAC Name: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(2-iodophenyl)prop-2-enamide Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-iodophenyl)acrylamide Formula: C20H18IN3O MolecularWeight: 443.28089

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)NC3=CC=CC=C3I

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)NC3=CC=CC=C3I

InChI

InChI=1S/C20H18IN3O/c1-14-17(15(2)24(23-14)16-8-4-3-5-9-16)12-13-20(25)22-19-11-7-6-10-18(19)21/h3-13H,1-2H3,(H,22,25)/b13-12+