N-[1-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-iodanyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[1-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-iodanyl-1H-pyrazole-5-carboxamide Openeye Name: N-[1-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-iodo-1H-pyrazole-5-carboxamide CAS Name: N-[1-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-iodo-1H-pyrazole-5-carboxamide IUPAC Name: N-[1-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-iodo-1H-pyrazole-5-carboxamide Traditional Name: N-[1-(4-fluorobenzyl)-1,2,4-triazol-3-yl]-4-iodo-1H-pyrazole-5-carboxamide Formula: C13H10FIN6O MolecularWeight: 412.160973

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC(=N2)NC(=O)C3=C(C=NN3)I)F

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC(=N2)NC(=O)C3=C(C=NN3)I)F

InChI

InChI=1S/C13H10FIN6O/c14-9-3-1-8(2-4-9)6-21-7-16-13(20-21)18-12(22)11-10(15)5-17-19-11/h1-5,7H,6H2,(H,17,19)(H,18,20,22)