3-bromanyl-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]benzamide

Systemtic Name: 3-bromanyl-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]benzamide Openeye Name: 3-bromo-N-[4-[3-ethoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide CAS Name: 3-bromo-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]benzamide IUPAC Name: 3-bromo-N-[4-[3-ethoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]benzamide Traditional Name: 3-bromo-N-[4-[3-ethoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide Formula: C24H21BrN4O2 MolecularWeight: 477.35314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C24H21BrN4O2/c1-3-31-24-27-22(17-9-7-16(2)8-10-17)29(28-24)21-13-11-20(12-14-21)26-23(30)18-5-4-6-19(25)15-18/h4-15H,3H2,1-2H3,(H,26,30)