2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium-8-ol perchlorate

Systemtic Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium-8-ol perchlorate Openeye Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium-8-ol perchlorate CAS Name: 2,4-dimethyl-8-pyrimido[2,1-b][1,3]benzothiazol-5-iumol perchlorate IUPAC Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium-8-ol perchlorate Traditional Name: 2,4-dimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium-8-ol perchlorate Formula: C12H11ClN2O5S MolecularWeight: 330.74414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C3=C(C=C(C=C3)O)SC2=N1)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+]2C3=C(C=C(C=C3)O)SC2=N1)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H10N2OS.ClHO4/c1-7-5-8(2)14-10-4-3-9(15)6-11(10)16-12(14)13-7;2-1(3,4)5/h3-6H,1-2H3;(H,2,3,4,5)