N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-iodanyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-iodanyl-1H-pyrazole-5-carboxamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-iodo-1H-pyrazole-5-carboxamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-4-iodo-1H-pyrazole-5-carboxamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-iodo-1H-pyrazole-5-carboxamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-iodo-1H-pyrazole-5-carboxamide Formula: C20H16IN5O MolecularWeight: 469.27841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=C(C=NN3)I)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=C(C=NN3)I)C4=CC=CC=C4

InChI

InChI=1S/C20H16IN5O/c21-17-12-23-24-19(17)20(27)22-11-15-13-26(16-9-5-2-6-10-16)25-18(15)14-7-3-1-4-8-14/h1-10,12-13H,11H2,(H,22,27)(H,23,24)