N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-3-(4-iodo-5-methyl-pyrazol-1-yl)propanamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-3-(4-iodo-5-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-3-(4-iodo-5-methylpyrazol-1-yl)propanamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-3-(4-iodo-5-methyl-pyrazol-1-yl)propionamide Formula: C17H16ClFIN5O MolecularWeight: 487.697713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl)I

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl)I

InChI

InChI=1S/C17H16ClFIN5O/c1-11-16(20)8-22-25(11)5-4-17(26)23-14-7-21-24(10-14)9-12-2-3-13(19)6-15(12)18/h2-3,6-8,10H,4-5,9H2,1H3,(H,23,26)