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

Systemtic Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate Openeye Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate CAS Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate IUPAC Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate Traditional Name: 2,4,8-trimethylpyrimido[2,1-b][1,3]benzothiazol-5-ium perchlorate Formula: C13H13ClN2O4S MolecularWeight: 328.77132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+]3=C(C=C(N=C3S2)C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC2=C(C=C1)[N+]3=C(C=C(N=C3S2)C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H13N2S.ClHO4/c1-8-4-5-11-12(6-8)16-13-14-9(2)7-10(3)15(11)13;2-1(3,4)5/h4-7H,1-3H3;(H,2,3,4,5)/q+1;/p-1