2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate

Systemtic Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate Openeye Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate CAS Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate IUPAC Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate Traditional Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate Formula: C12H11ClN2O4S MolecularWeight: 314.74474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C3=CC=CC=C3SC2=N1)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+]2C3=CC=CC=C3SC2=N1)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H11N2S.ClHO4/c1-8-7-9(2)14-10-5-3-4-6-11(10)15-12(14)13-8;2-1(3,4)5/h3-7H,1-2H3;(H,2,3,4,5)/q+1;/p-1