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ethyl (2Z)-2-[2-(cyanomethoxy)benzylidene]-5-(4-fluorophenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK698465
SMILES N#CCOc1ccccc1/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)F)C(=O)OCC)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H22FN3O4S MW 539.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22FN3O4S/c1-2-37-29(36)25-26(19-8-4-3-5-9-19)33-30-34(27(25)20-12-14-22(31)15-13-20)28(35)24(39-30)18-21-10-6-7-11-23(21)38-17-16-32/h3-15,18,27H,2,17H2,1H3/b24-18-
InChIKey
AHCKGQCFYJWKRE-MOHJPFBDSA-N
Synonyms

(Z)ethyl2(2(cyanomethoxy)benzylidene)5(4fluorophenyl)3oxo7phenyl35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)F)C(=O)C(=CC4=CC=CC=C4OCC#N)S2)C5=CC=CC=C5
ETHYL(2Z)2((2(CYANOMETHOXY)PHENYL)METHYLIDENE)5(4FLUOROPHENYL)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(2(CYANOMETHOXY)BENZYLIDENE)5(4FLUOROPHENYL)3OXO7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2(2(CYANOMETHOXY)BENZYLIDENE)5(4FLUOROPHENYL)3OXO7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H22FN3O4Sc123729(36)2526(198435919)333034(27(25)20121422(31)151320)28(35)24(3930)182110671123(21)38171632h3151827H217H21H3b2418
MFCD02197619
N#CCOc1ccccc1C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)F)C(=O)OCC)c1ccccc1
ZINC000002174060
ZINC000002174062

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Available files

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