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

Systemtic Name: 4-iodanyl-2-methyl-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Openeye Name: 4-iodo-2-methyl-N-[1-(o-tolylmethyl)pyrazol-3-yl]pyrazole-3-carboxamide CAS Name: 4-iodo-2-methyl-N-[1-[(2-methylphenyl)methyl]-3-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 4-iodo-2-methyl-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Traditional Name: 4-iodo-2-methyl-N-[1-(2-methylbenzyl)pyrazol-3-yl]pyrazole-3-carboxamide Formula: C16H16IN5O MolecularWeight: 421.23561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)C3=C(C=NN3C)I

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)C3=C(C=NN3C)I

InChI

InChI=1S/C16H16IN5O/c1-11-5-3-4-6-12(11)10-22-8-7-14(20-22)19-16(23)15-13(17)9-18-21(15)2/h3-9H,10H2,1-2H3,(H,19,20,23)