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

Systemtic Name: 2-ethyl-N-[3-[3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide Openeye Name: 2-ethyl-N-[3-[3-(4-iodo-5-methyl-pyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide CAS Name: 2-ethyl-N-[3-[[3-(4-iodo-5-methyl-1-pyrazolyl)-1-oxopropyl]amino]phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-N-[3-[3-(4-iodo-5-methylpyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide Traditional Name: 2-ethyl-N-[3-[3-(4-iodo-5-methyl-pyrazol-1-yl)propanoylamino]phenyl]pyrazole-3-carboxamide Formula: C19H21IN6O2 MolecularWeight: 492.31351

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(=O)NC2=CC(=CC=C2)NC(=O)CCN3C(=C(C=N3)I)C

Isomeric SMILES

CCN1C(=CC=N1)C(=O)NC2=CC(=CC=C2)NC(=O)CCN3C(=C(C=N3)I)C

InChI

InChI=1S/C19H21IN6O2/c1-3-25-17(7-9-21-25)19(28)24-15-6-4-5-14(11-15)23-18(27)8-10-26-13(2)16(20)12-22-26/h4-7,9,11-12H,3,8,10H2,1-2H3,(H,23,27)(H,24,28)