6H-azepino[2,1-b][1,3]benzothiazol-11-ium

Systemtic Name: 6H-azepino[2,1-b][1,3]benzothiazol-11-ium Openeye Name: 6H-azepino[2,1-b][1,3]benzothiazol-11-ium CAS Name: 6H-azepino[2,1-b][1,3]benzothiazol-11-ium IUPAC Name: 6H-azepino[2,1-b][1,3]benzothiazol-11-ium Traditional Name: 6H-azepino[2,1-b][1,3]benzothiazol-11-ium Formula: C12H10NS+ MolecularWeight: 200.2795

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C[N+]2=C1SC3=CC=CC=C32

Isomeric SMILES

C1C=CC=C[N+]2=C1SC3=CC=CC=C32

InChI

InChI=1S/C12H10NS/c1-2-8-12-13(9-5-1)10-6-3-4-7-11(10)14-12/h1-7,9H,8H2/q+1