methyl 2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: methyl 2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl 2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 2-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methylidene]-7-methyl-5-[4-(methylthio)phenyl]-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 2-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-keto-7-methyl-5-[4-(methylthio)phenyl]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C32H25FN4O3S2 MolecularWeight: 596.694303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5)SC2=N1)C6=CC=C(C=C6)SC)C(=O)OC

Isomeric SMILES

CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5)SC2=N1)C6=CC=C(C=C6)SC)C(=O)OC

InChI

InChI=1S/C32H25FN4O3S2/c1-19-27(31(39)40-2)29(21-11-15-25(41-3)16-12-21)37-30(38)26(42-32(37)34-19)17-22-18-36(24-7-5-4-6-8-24)35-28(22)20-9-13-23(33)14-10-20/h4-18,29H,1-3H3