3-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium

Systemtic Name: 3-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium Openeye Name: 3-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium CAS Name: 3-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium IUPAC Name: 3-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium Traditional Name: 3-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium Formula: C8H12NS+ MolecularWeight: 154.25258

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CSC2=C1CCCC2

Isomeric SMILES

C[N+]1=CSC2=C1CCCC2

InChI

InChI=1S/C8H12NS/c1-9-6-10-8-5-3-2-4-7(8)9/h6H,2-5H2,1H3/q+1