(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 4-ethyl-1,2,3-thiadiazole-5-carboxylate

Systemtic Name: (7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 4-ethyl-1,2,3-thiadiazole-5-carboxylate Openeye Name: (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 4-ethylthiadiazole-5-carboxylate CAS Name: 4-ethyl-5-thiadiazolecarboxylic acid (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 4-ethylthiadiazole-5-carboxylate Traditional Name: 4-ethylthiadiazole-5-carboxylic acid (4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C15H15N4O3S+ MolecularWeight: 331.3696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)C

Isomeric SMILES

CCC1=C(SN=N1)C(=O)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)C

InChI

InChI=1S/C15H14N4O3S/c1-3-11-14(23-18-17-11)15(21)22-8-10-6-13(20)19-7-9(2)4-5-12(19)16-10/h4-7H,3,8H2,1-2H3/p+1