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

Systemtic Name: N-[3-[3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[3-[3-(4-iodo-3-methyl-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[3-[[3-(4-iodo-3-methyl-1-pyrazolyl)-1-oxopropyl]amino]phenyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3-[3-(4-iodo-3-methylpyrazol-1-yl)propanoylamino]phenyl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[3-[3-(4-iodo-3-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=NN(C=C1I)CCC(=O)NC2=CC=CC(=C2)NC(=O)C3=NN(C=C3)C

Isomeric SMILES

CC1=NN(C=C1I)CCC(=O)NC2=CC=CC(=C2)NC(=O)C3=NN(C=C3)C

InChI

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