ethyl (2Z)-2-[[4-(cyanomethoxy)-3-methoxy-phenyl]methylidene]-5-(4-fluorophenyl)-3-oxidanylidene-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl (2Z)-2-[[4-(cyanomethoxy)-3-methoxy-phenyl]methylidene]-5-(4-fluorophenyl)-3-oxidanylidene-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl (2Z)-2-[[4-(cyanomethoxy)-3-methoxy-phenyl]methylene]-5-(4-fluorophenyl)-3-oxo-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: (2Z)-2-[[4-(cyanomethoxy)-3-methoxyphenyl]methylidene]-5-(4-fluorophenyl)-3-oxo-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[[4-(cyanomethoxy)-3-methoxyphenyl]methylidene]-5-(4-fluorophenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: (2Z)-2-[4-(cyanomethoxy)-3-methoxy-benzylidene]-5-(4-fluorophenyl)-3-keto-7-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C31H24FN3O5S MolecularWeight: 569.602763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)F)C(=O)C(=CC4=CC(=C(C=C4)OCC#N)OC)S2)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)F)C(=O)/C(=C/C4=CC(=C(C=C4)OCC#N)OC)/S2)C5=CC=CC=C5

InChI

InChI=1S/C31H24FN3O5S/c1-3-39-30(37)26-27(20-7-5-4-6-8-20)34-31-35(28(26)21-10-12-22(32)13-11-21)29(36)25(41-31)18-19-9-14-23(40-16-15-33)24(17-19)38-2/h4-14,17-18,28H,3,16H2,1-2H3/b25-18-