methyl (2Z)-5-(4-butoxy-3-methoxy-phenyl)-2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: methyl (2Z)-5-(4-butoxy-3-methoxy-phenyl)-2-[(2-chloranyl-6-fluoranyl-phenyl)methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl (2Z)-5-(4-butoxy-3-methoxy-phenyl)-2-[(2-chloro-6-fluoro-phenyl)methylene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: (2Z)-5-(4-butoxy-3-methoxyphenyl)-2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (2Z)-5-(4-butoxy-3-methoxyphenyl)-2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: (2Z)-5-(4-butoxy-3-methoxy-phenyl)-2-(2-chloro-6-fluoro-benzylidene)-3-keto-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C27H26ClFN2O5S MolecularWeight: 545.022143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=C(C=CC=C4Cl)F)S3)C)C(=O)OC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)/C(=C/C4=C(C=CC=C4Cl)F)/S3)C)C(=O)OC)OC

InChI

InChI=1S/C27H26ClFN2O5S/c1-5-6-12-36-20-11-10-16(13-21(20)34-3)24-23(26(33)35-4)15(2)30-27-31(24)25(32)22(37-27)14-17-18(28)8-7-9-19(17)29/h7-11,13-14,24H,5-6,12H2,1-4H3/b22-14-