N-[4-[3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[4-[3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[4-[3-(4-iodo-5-methyl-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[4-[[3-(4-iodo-5-methyl-1-pyrazolyl)-1-oxopropyl]amino]phenyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[4-[3-(4-iodo-5-methylpyrazol-1-yl)propanoylamino]phenyl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[4-[3-(4-iodo-5-methyl-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide Formula: C18H19IN6O2 MolecularWeight: 478.28693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)C)I

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)C)I

InChI

InChI=1S/C18H19IN6O2/c1-12-15(19)11-20-25(12)10-8-17(26)21-13-3-5-14(6-4-13)22-18(27)16-7-9-24(2)23-16/h3-7,9,11H,8,10H2,1-2H3,(H,21,26)(H,22,27)