1-(2-bromophenyl)-N-[4-(tert-butylcarbamoyl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-[4-(tert-butylcarbamoyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-bromophenyl)-N-[4-(tert-butylcarbamoyl)phenyl]triazole-4-carboxamide CAS Name: 1-(2-bromophenyl)-N-[4-[(tert-butylamino)-oxomethyl]phenyl]-4-triazolecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-[4-(tert-butylcarbamoyl)phenyl]triazole-4-carboxamide Traditional Name: 1-(2-bromophenyl)-N-[4-(tert-butylcarbamoyl)phenyl]triazole-4-carboxamide Formula: C20H20BrN5O2 MolecularWeight: 442.3091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrN5O2/c1-20(2,3)23-18(27)13-8-10-14(11-9-13)22-19(28)16-12-26(25-24-16)17-7-5-4-6-15(17)21/h4-12H,1-3H3,(H,22,28)(H,23,27)