1-(2-bromophenyl)-N-(3-iodanyl-4-methyl-phenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-(3-iodanyl-4-methyl-phenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-bromophenyl)-N-(3-iodo-4-methyl-phenyl)triazole-4-carboxamide CAS Name: 1-(2-bromophenyl)-N-(3-iodo-4-methylphenyl)-4-triazolecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-(3-iodo-4-methylphenyl)triazole-4-carboxamide Traditional Name: 1-(2-bromophenyl)-N-(3-iodo-4-methyl-phenyl)triazole-4-carboxamide Formula: C16H12BrIN4O MolecularWeight: 483.10115

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3Br)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3Br)I

InChI

InChI=1S/C16H12BrIN4O/c1-10-6-7-11(8-13(10)18)19-16(23)14-9-22(21-20-14)15-5-3-2-4-12(15)17/h2-9H,1H3,(H,19,23)