(3-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl 5-methylthiophene-2-carboxylate

Systemtic Name: (3-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl 5-methylthiophene-2-carboxylate Openeye Name: (3-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl 5-methylthiophene-2-carboxylate CAS Name: 5-methyl-2-thiophenecarboxylic acid (3-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl ester IUPAC Name: (3-methyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl 5-methylthiophene-2-carboxylate Traditional Name: 5-methylthiophene-2-carboxylic acid (5-keto-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl ester Formula: C14H13N2O3S2+ MolecularWeight: 321.39462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)OCC2=CC(=O)[N+]3=C(N2)SC=C3C

Isomeric SMILES

CC1=CC=C(S1)C(=O)OCC2=CC(=O)[N+]3=C(N2)SC=C3C

InChI

InChI=1S/C14H12N2O3S2/c1-8-7-20-14-15-10(5-12(17)16(8)14)6-19-13(18)11-4-3-9(2)21-11/h3-5,7H,6H2,1-2H3/p+1