4-[4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanoylamino]benzamide

Systemtic Name: 4-[4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanoylamino]benzamide Openeye Name: 4-[4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butanoylamino]benzamide CAS Name: 4-[[4-(4-iodo-3,5-dimethyl-1-pyrazolyl)-1-oxobutyl]amino]benzamide IUPAC Name: 4-[4-(4-iodo-3,5-dimethylpyrazol-1-yl)butanoylamino]benzamide Traditional Name: 4-[4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butanoylamino]benzamide Formula: C16H19IN4O2 MolecularWeight: 426.25213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=CC=C(C=C2)C(=O)N)C)I

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=CC=C(C=C2)C(=O)N)C)I

InChI

InChI=1S/C16H19IN4O2/c1-10-15(17)11(2)21(20-10)9-3-4-14(22)19-13-7-5-12(6-8-13)16(18)23/h5-8H,3-4,9H2,1-2H3,(H2,18,23)(H,19,22)