3-[4,6,7-tris(chloranyl)-1,3-benzothiazol-2-yl]propylazanium

Systemtic Name: 3-[4,6,7-tris(chloranyl)-1,3-benzothiazol-2-yl]propylazanium Openeye Name: 3-(4,6,7-trichloro-1,3-benzothiazol-2-yl)propylammonium CAS Name: 3-(4,6,7-trichloro-1,3-benzothiazol-2-yl)propylammonium IUPAC Name: 3-(4,6,7-trichloro-1,3-benzothiazol-2-yl)propylazanium Traditional Name: 3-(4,6,7-trichloro-1,3-benzothiazol-2-yl)propylammonium Formula: C10H10Cl3N2S+ MolecularWeight: 296.6238

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(C(=C1Cl)Cl)SC(=N2)CCC[NH3+])Cl

Isomeric SMILES

C1=C(C2=C(C(=C1Cl)Cl)SC(=N2)CCC[NH3+])Cl

InChI

InChI=1S/C10H9Cl3N2S/c11-5-4-6(12)9-10(8(5)13)16-7(15-9)2-1-3-14/h4H,1-3,14H2/p+1