ethyl 5-cyclopropyl-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-3-carboxylate perchlorate

Systemtic Name: ethyl 5-cyclopropyl-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-3-carboxylate perchlorate Openeye Name: ethyl 5-cyclopropyl-7-methyl-thiazolo[3,2-a]pyrimidin-4-ium-3-carboxylate perchlorate CAS Name: 5-cyclopropyl-7-methyl-3-thiazolo[3,2-a]pyrimidin-4-iumcarboxylic acid ethyl ester perchlorate IUPAC Name: ethyl 5-cyclopropyl-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-3-carboxylate perchlorate Traditional Name: 5-cyclopropyl-7-methyl-thiazolo[3,2-a]pyrimidin-4-ium-3-carboxylic acid ethyl ester perchlorate Formula: C13H15ClN2O6S MolecularWeight: 362.786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC2=[N+]1C(=CC(=N2)C)C3CC3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC(=O)C1=CSC2=[N+]1C(=CC(=N2)C)C3CC3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H15N2O2S.ClHO4/c1-3-17-12(16)11-7-18-13-14-8(2)6-10(15(11)13)9-4-5-9;2-1(3,4)5/h6-7,9H,3-5H2,1-2H3;(H,2,3,4,5)/q+1;/p-1