N-(1,3-benzodioxol-5-ylmethyl)-5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-1H-pyrazol-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-1H-pyrazol-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-1H-pyrazol-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-1H-pyrazol-4-amine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-1H-pyrazol-4-amine Traditional Name: [5-[3-(3-bromophenyl)-1H-1,2,4-triazol-5-yl]-1H-pyrazol-4-yl]-piperonyl-amine Formula: C19H15BrN6O2 MolecularWeight: 439.2654

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(NN=C3)C4=NC(=NN4)C5=CC(=CC=C5)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(NN=C3)C4=NC(=NN4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C19H15BrN6O2/c20-13-3-1-2-12(7-13)18-23-19(26-25-18)17-14(9-22-24-17)21-8-11-4-5-15-16(6-11)28-10-27-15/h1-7,9,21H,8,10H2,(H,22,24)(H,23,25,26)