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

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-1-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-1-phenyl-triazole-4-carboxamide CAS Name: N-(3-iodo-4-methylphenyl)-1-phenyl-4-triazolecarboxamide IUPAC Name: N-(3-iodo-4-methylphenyl)-1-phenyltriazole-4-carboxamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-1-phenyl-triazole-4-carboxamide Formula: C16H13IN4O MolecularWeight: 404.20509

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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=C3)I

Isomeric SMILES

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

InChI

InChI=1S/C16H13IN4O/c1-11-7-8-12(9-14(11)17)18-16(22)15-10-21(20-19-15)13-5-3-2-4-6-13/h2-10H,1H3,(H,18,22)