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

Systemtic Name: methyl 5-(4-butoxyphenyl)-2-ethyl-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl 5-(4-butoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 5-(4-butoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-butoxyphenyl)-2-ethyl-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 5-(4-butoxyphenyl)-2-ethyl-3-keto-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S/c1-5-7-12-27-15-10-8-14(9-11-15)18-17(20(25)26-4)13(3)22-21-23(18)19(24)16(6-2)28-21/h8-11,16,18H,5-7,12H2,1-4H3