4-iodanyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-iodanyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide Openeye Name: 4-iodo-N-[1-(o-tolylmethyl)pyrazol-4-yl]-1H-pyrazole-5-carboxamide CAS Name: 4-iodo-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-iodo-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide Traditional Name: 4-iodo-N-[1-(2-methylbenzyl)pyrazol-4-yl]-1H-pyrazole-5-carboxamide Formula: C15H14IN5O MolecularWeight: 407.20903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=C(C=NN3)I

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=C(C=NN3)I

InChI

InChI=1S/C15H14IN5O/c1-10-4-2-3-5-11(10)8-21-9-12(6-18-21)19-15(22)14-13(16)7-17-20-14/h2-7,9H,8H2,1H3,(H,17,20)(H,19,22)