1-(3-bromophenyl)-N-[[3-(furan-2-ylcarbonylamino)phenyl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-[[3-(furan-2-ylcarbonylamino)phenyl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3-bromophenyl)-N-[[3-(furan-2-carbonylamino)phenyl]methyl]triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-[[3-[[2-furanyl(oxo)methyl]amino]phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-[[3-(furan-2-carbonylamino)phenyl]methyl]triazole-4-carboxamide Traditional Name: 1-(3-bromophenyl)-N-[3-(2-furoylamino)benzyl]triazole-4-carboxamide Formula: C21H16BrN5O3 MolecularWeight: 466.28744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=CO2)CNC(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=CO2)CNC(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H16BrN5O3/c22-15-5-2-7-17(11-15)27-13-18(25-26-27)20(28)23-12-14-4-1-6-16(10-14)24-21(29)19-8-3-9-30-19/h1-11,13H,12H2,(H,23,28)(H,24,29)