N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(4-iodanylpyrazol-1-yl)ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(4-iodanylpyrazol-1-yl)ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-(4-iodopyrazol-1-yl)acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-(4-iodo-1-pyrazolyl)acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(4-iodopyrazol-1-yl)acetamide Traditional Name: 2-(4-iodopyrazol-1-yl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C16H16IN5O2 MolecularWeight: 437.23501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CN3C=C(C=N3)I

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CN3C=C(C=N3)I

InChI

InChI=1S/C16H16IN5O2/c1-11-15(19-14(23)10-21-9-12(17)8-18-21)16(24)22(20(11)2)13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,19,23)