ethyl 3,8,9-trimethyl-2-oxidanyl-4-oxidanylidene-6-phenyl-6H-pyrimido[2,1-b][1,3]thiazin-5-ium-7-carboxylate

Systemtic Name: ethyl 3,8,9-trimethyl-2-oxidanyl-4-oxidanylidene-6-phenyl-6H-pyrimido[2,1-b][1,3]thiazin-5-ium-7-carboxylate Openeye Name: ethyl 2-hydroxy-3,8,9-trimethyl-4-oxo-6-phenyl-6H-pyrimido[2,1-b][1,3]thiazin-5-ium-7-carboxylate CAS Name: 2-hydroxy-3,8,9-trimethyl-4-oxo-6-phenyl-6H-pyrimido[2,1-b][1,3]thiazin-5-ium-7-carboxylic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-3,8,9-trimethyl-4-oxo-6-phenyl-6H-pyrimido[2,1-b][1,3]thiazin-5-ium-7-carboxylate Traditional Name: 2-hydroxy-4-keto-3,8,9-trimethyl-6-phenyl-6H-pyrimido[2,1-b][1,3]thiazin-5-ium-7-carboxylic acid ethyl ester Formula: C19H21N2O4S+ MolecularWeight: 373.44604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=[N+](C1C3=CC=CC=C3)C(=O)C(=C(S2)O)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=[N+](C1C3=CC=CC=C3)C(=O)C(=C(S2)O)C)C)C

InChI

InChI=1S/C19H20N2O4S/c1-5-25-17(23)14-12(3)20(4)19-21(16(22)11(2)18(24)26-19)15(14)13-9-7-6-8-10-13/h6-10,15H,5H2,1-4H3/p+1