ethyl 7,8-dimethyl-3-oxidanyl-2,5-diphenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxylate

Systemtic Name: ethyl 7,8-dimethyl-3-oxidanyl-2,5-diphenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxylate Openeye Name: ethyl 3-hydroxy-7,8-dimethyl-2,5-diphenyl-5H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxylate CAS Name: 3-hydroxy-7,8-dimethyl-2,5-diphenyl-5H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-7,8-dimethyl-2,5-diphenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxylate Traditional Name: 3-hydroxy-7,8-dimethyl-2,5-diphenyl-5H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxylic acid ethyl ester Formula: C23H23N2O3S+ MolecularWeight: 407.50532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=[N+](C1C3=CC=CC=C3)C(=C(S2)C4=CC=CC=C4)O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=[N+](C1C3=CC=CC=C3)C(=C(S2)C4=CC=CC=C4)O)C)C

InChI

InChI=1S/C23H22N2O3S/c1-4-28-22(27)18-15(2)24(3)23-25(19(18)16-11-7-5-8-12-16)21(26)20(29-23)17-13-9-6-10-14-17/h5-14,19H,4H2,1-3H3/p+1