5-chloranyl-3-ethyl-2-methyl-1,3-benzothiazol-3-ium

Systemtic Name: 5-chloranyl-3-ethyl-2-methyl-1,3-benzothiazol-3-ium Openeye Name: 5-chloro-3-ethyl-2-methyl-1,3-benzothiazol-3-ium CAS Name: 5-chloro-3-ethyl-2-methyl-1,3-benzothiazol-3-ium IUPAC Name: 5-chloro-3-ethyl-2-methyl-1,3-benzothiazol-3-ium Traditional Name: 5-chloro-3-ethyl-2-methyl-1,3-benzothiazol-3-ium Formula: C10H11ClNS+ MolecularWeight: 212.71904

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=C1C=C(C=C2)Cl)C

Isomeric SMILES

CC[N+]1=C(SC2=C1C=C(C=C2)Cl)C

InChI

InChI=1S/C10H11ClNS/c1-3-12-7(2)13-10-5-4-8(11)6-9(10)12/h4-6H,3H2,1-2H3/q+1