2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium

Systemtic Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium Openeye Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium CAS Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium IUPAC Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium Traditional Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium Formula: C13H13N2S+ MolecularWeight: 229.32072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+]3=C(C=C(N=C3S2)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)[N+]3=C(C=C(N=C3S2)C)C

InChI

InChI=1S/C13H13N2S/c1-8-4-5-11-12(6-8)16-13-14-9(2)7-10(3)15(11)13/h4-7H,1-3H3/q+1