methyl (2E)-2-[(2-acetyloxy-5-bromanyl-phenyl)methylidene]-7-methyl-3-oxidanylidene-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: methyl (2E)-2-[(2-acetyloxy-5-bromanyl-phenyl)methylidene]-7-methyl-3-oxidanylidene-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl (2E)-2-[(2-acetoxy-5-bromo-phenyl)methylene]-7-methyl-3-oxo-5-(2-thienyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: (2E)-2-[(2-acetyloxy-5-bromophenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (2E)-2-[(2-acetyloxy-5-bromophenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: (2E)-2-(2-acetoxy-5-bromo-benzylidene)-3-keto-7-methyl-5-(2-thienyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C22H17BrN2O5S2 MolecularWeight: 533.41478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=O)C(=CC3=C(C=CC(=C3)Br)OC(=O)C)SC2=N1)C4=CC=CS4)C(=O)OC

Isomeric SMILES

CC1=C(C(N2C(=O)/C(=C\C3=C(C=CC(=C3)Br)OC(=O)C)/SC2=N1)C4=CC=CS4)C(=O)OC

InChI

InChI=1S/C22H17BrN2O5S2/c1-11-18(21(28)29-3)19(16-5-4-8-31-16)25-20(27)17(32-22(25)24-11)10-13-9-14(23)6-7-15(13)30-12(2)26/h4-10,19H,1-3H3/b17-10+