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ethyl (2Z)-2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK525119
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)[N+](=O)[O-])c(=O)/c(=C/c1cn(nc1c1ccc(cc1)Cl)c1ccccc1)/s2

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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 C32H24ClN5O5S MW 626.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24ClN5O5S/c1-3-43-31(40)27-19(2)34-32-37(29(27)21-8-7-11-25(16-21)38(41)42)30(39)26(44-32)17-22-18-36(24-9-5-4-6-10-24)35-28(22)20-12-14-23(33)15-13-20/h4-18,29H,3H2,1-2H3/b26-17-
InChIKey
MRRFUPGJFYRRNF-ONUIUJJFSA-N
Synonyms

(Z)ethyl2((3(4chlorophenyl)1phenyl1Hpyrazol4yl)methylene)7methyl5(3nitrophenyl)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)(N+)(=O)(O))c(=O)c(=Cc1cn(nc1c1ccc(cc1)Cl)c1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)Cl)C6=CC=CC=C6)S2)C
ethyl(2Z)2((3(4chlorophenyl)1phenyl1Hpyrazol4yl)methylidene)7methyl5(3nitrophenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((3(4CHLOROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)7METHYL5(3NITROPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((3(4CHLOROPHENYL)1PHENYLPYRAZOL4YL)METHYLENE)7METHYL5(3NITROPHENYL)3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H24ClN5O5Sc134331(40)2719(2)343237(29(27)21871125(1621)38(41)42)30(39)26(4432)17221836(2495461024)3528(22)20121423(33)151320h41829H3H212H3b2617
MFCD01072748
ZINC000033358243
ZINC000033358244

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Available files

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