5-(1,3-benzodioxol-5-yl)-N-(3-indazol-1-ylpropyl)-1,2,4-triazin-3-amine

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-(3-indazol-1-ylpropyl)-1,2,4-triazin-3-amine Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-(3-indazol-1-ylpropyl)-1,2,4-triazin-3-amine CAS Name: 5-(1,3-benzodioxol-5-yl)-N-[3-(1-indazolyl)propyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-(3-indazol-1-ylpropyl)-1,2,4-triazin-3-amine Traditional Name: [5-(1,3-benzodioxol-5-yl)-1,2,4-triazin-3-yl]-(3-indazol-1-ylpropyl)amine Formula: C20H18N6O2 MolecularWeight: 374.39592

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CN=NC(=N3)NCCCN4C5=CC=CC=C5C=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CN=NC(=N3)NCCCN4C5=CC=CC=C5C=N4

InChI

InChI=1S/C20H18N6O2/c1-2-5-17-15(4-1)11-23-26(17)9-3-8-21-20-24-16(12-22-25-20)14-6-7-18-19(10-14)28-13-27-18/h1-2,4-7,10-12H,3,8-9,13H2,(H,21,24,25)