methyl 5-(4-butoxy-3-ethoxy-phenyl)-2-ethyl-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-(4-butoxy-3-ethoxy-phenyl)-2-ethyl-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl 5-(4-butoxy-3-ethoxy-phenyl)-2-ethyl-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 5-(4-butoxy-3-ethoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-butoxy-3-ethoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 5-(4-butoxy-3-ethoxy-phenyl)-2-ethyl-3-keto-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)C(S3)CC)C)C(=O)OC)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)C(S3)CC)C)C(=O)OC)OCC

InChI

InChI=1S/C23H30N2O5S/c1-6-9-12-30-16-11-10-15(13-17(16)29-8-3)20-19(22(27)28-5)14(4)24-23-25(20)21(26)18(7-2)31-23/h10-11,13,18,20H,6-9,12H2,1-5H3