1,3-benzothiazol-3-ium; 1,3-thiazol-3-ium

Systemtic Name: 1,3-benzothiazol-3-ium; 1,3-thiazol-3-ium Openeye Name: 1,3-benzothiazol-3-ium; thiazol-3-ium CAS Name: 1,3-benzothiazol-3-ium; thiazol-3-ium IUPAC Name: 1,3-benzothiazol-3-ium; 1,3-thiazol-3-ium Traditional Name: 1,3-benzothiazol-3-ium; thiazol-3-ium Formula: C10H10N2S2+2 MolecularWeight: 222.3298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[NH+]=CS2.C1=CSC=[NH+]1

Isomeric SMILES

C1=CC=C2C(=C1)[NH+]=CS2.C1=CSC=[NH+]1

InChI

InChI=1S/C7H5NS.C3H3NS/c1-2-4-7-6(3-1)8-5-9-7;1-2-5-3-4-1/h1-5H;1-3H/p+2