2-(4-iodanylphenoxy)-N-[(E)-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]ethanamide

Systemtic Name: 2-(4-iodanylphenoxy)-N-[(E)-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]ethanamide Openeye Name: 2-(4-iodophenoxy)-N-[(E)-[3-(m-tolyl)-1-phenyl-pyrazol-4-yl]methyleneamino]acetamide CAS Name: 2-(4-iodophenoxy)-N-[(E)-[3-(3-methylphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]acetamide IUPAC Name: 2-(4-iodophenoxy)-N-[(E)-[3-(3-methylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]acetamide Traditional Name: 2-(4-iodophenoxy)-N-[(E)-[3-(m-tolyl)-1-phenyl-pyrazol-4-yl]methyleneamino]acetamide Formula: C25H21IN4O2 MolecularWeight: 536.36431

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN(C=C2C=NNC(=O)COC3=CC=C(C=C3)I)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN(C=C2/C=N/NC(=O)COC3=CC=C(C=C3)I)C4=CC=CC=C4

InChI

InChI=1S/C25H21IN4O2/c1-18-6-5-7-19(14-18)25-20(16-30(29-25)22-8-3-2-4-9-22)15-27-28-24(31)17-32-23-12-10-21(26)11-13-23/h2-16H,17H2,1H3,(H,28,31)/b27-15+