N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-[1-[(2,4-dimethylphenoxy)methyl]-4-pyrazolyl]-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-4-iodo-1-methyl-pyrazole-3-carboxamide Formula: C17H18IN5O2 MolecularWeight: 451.26159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCN2C=C(C=N2)NC(=O)C3=NN(C=C3I)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCN2C=C(C=N2)NC(=O)C3=NN(C=C3I)C)C

InChI

InChI=1S/C17H18IN5O2/c1-11-4-5-15(12(2)6-11)25-10-23-8-13(7-19-23)20-17(24)16-14(18)9-22(3)21-16/h4-9H,10H2,1-3H3,(H,20,24)