3-(1,3-benzodioxol-5-yl)-2-phenyl-1,2,4-thiadiazol-2-ium-5-amine

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-phenyl-1,2,4-thiadiazol-2-ium-5-amine Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-phenyl-1,2,4-thiadiazol-2-ium-5-amine CAS Name: 3-(1,3-benzodioxol-5-yl)-2-phenyl-1,2,4-thiadiazol-2-ium-5-amine IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-phenyl-1,2,4-thiadiazol-2-ium-5-amine Traditional Name: [3-(1,3-benzodioxol-5-yl)-2-phenyl-1,2,4-thiadiazol-2-ium-5-yl]amine Formula: C15H12N3O2S+ MolecularWeight: 298.33968

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=[N+](SC(=N3)N)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=[N+](SC(=N3)N)C4=CC=CC=C4

InChI

InChI=1S/C15H11N3O2S/c16-15-17-14(18(21-15)11-4-2-1-3-5-11)10-6-7-12-13(8-10)20-9-19-12/h1-8,16H,9H2/p+1