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

Systemtic Name: N-[4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-[4-[(4-bromo-1-pyrazolyl)methyl]phenyl]-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide Formula: C15H13BrIN5O MolecularWeight: 486.10509

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CC=C(C=C2)CN3C=C(C=N3)Br)I

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CC=C(C=C2)CN3C=C(C=N3)Br)I

InChI

InChI=1S/C15H13BrIN5O/c1-21-9-13(17)14(20-21)15(23)19-12-4-2-10(3-5-12)7-22-8-11(16)6-18-22/h2-6,8-9H,7H2,1H3,(H,19,23)