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

Catalog ID
STK798970
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1cn(nc1c1ccc(c(c1)[N+](=O)[O-])OC)c1ccccc1)/s2)C(=O)OC(C)C

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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 C35H31N5O7S MW 665.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H31N5O7S/c1-20(2)47-34(42)30-21(3)36-35-39(32(30)22-11-14-26(45-4)15-12-22)33(41)29(48-35)18-24-19-38(25-9-7-6-8-10-25)37-31(24)23-13-16-28(46-5)27(17-23)40(43)44/h6-20,32H,1-5H3/b29-18-
InChIKey
LRJVZMHOPCEBRH-MIXAMLLLSA-N
Synonyms

CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC(=C(C=C4)OC)(N+)(=O)(O))C5=CC=CC=C5)SC2=N1)C6=CC=C(C=C6)OC)C(=O)OC(C)C
COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cn(nc1c1ccc(c(c1)(N+)(=O)(O))OC)c1ccccc1)s2)C(=O)OC(C)C
InChI=1SC35H31N5O7Sc120(2)4734(42)3021(3)363539(32(30)22111426(454)151222)33(41)29(4835)18241938(2597681025)3731(24)23131628(465)27(1723)40(43)44h62032H15H3b2918
MFCD03462170
propan2yl(2Z)2((3(4methoxy3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROPAN2YL(2Z)2((3(4METHOXY3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000150398813
ZINC000150398818

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Available files

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