5-(1,3-benzodioxol-5-ylmethylamino)-N-phenyl-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylamino)-N-phenyl-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-ylmethylamino)-1-benzyl-N-phenyl-triazole-4-carboxamide CAS Name: 5-(1,3-benzodioxol-5-ylmethylamino)-N-phenyl-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylamino)-1-benzyl-N-phenyltriazole-4-carboxamide Traditional Name: 1-benzyl-N-phenyl-5-(piperonylamino)triazole-4-carboxamide Formula: C24H21N5O3 MolecularWeight: 427.45524

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(N=NN3CC4=CC=CC=C4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(N=NN3CC4=CC=CC=C4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C24H21N5O3/c30-24(26-19-9-5-2-6-10-19)22-23(29(28-27-22)15-17-7-3-1-4-8-17)25-14-18-11-12-20-21(13-18)32-16-31-20/h1-13,25H,14-16H2,(H,26,30)