2,4-dimethyl-6-methylsulfanyl-8-phenyl-[1,3]thiazolo[3,4-a]pyrimidin-5-ium perchlorate

Systemtic Name: 2,4-dimethyl-6-methylsulfanyl-8-phenyl-[1,3]thiazolo[3,4-a]pyrimidin-5-ium perchlorate Openeye Name: 2,4-dimethyl-6-methylsulfanyl-8-phenyl-thiazolo[3,4-a]pyrimidin-5-ium perchlorate CAS Name: 2,4-dimethyl-6-(methylthio)-8-phenylthiazolo[3,4-a]pyrimidin-5-ium perchlorate IUPAC Name: 2,4-dimethyl-6-methylsulfanyl-8-phenyl-[1,3]thiazolo[3,4-a]pyrimidin-5-ium perchlorate Traditional Name: 2,4-dimethyl-6-(methylthio)-8-phenyl-thiazolo[3,4-a]pyrimidin-5-ium perchlorate Formula: C15H15ClN2O4S2 MolecularWeight: 386.8736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(SC(=[N+]12)SC)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=NC2=C(SC(=[N+]12)SC)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C15H15N2S2.ClHO4/c1-10-9-11(2)17-14(16-10)13(19-15(17)18-3)12-7-5-4-6-8-12;2-1(3,4)5/h4-9H,1-3H3;(H,2,3,4,5)/q+1;/p-1