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

Catalog ID
STK799371
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)OCCC(C)C)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 C40H40N4O7S MW 720.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H40N4O7S/c1-7-49-39(47)35-25(4)41-40-44(37(35)28-15-18-32(51-26(5)45)33(21-28)48-6)38(46)34(52-40)22-29-23-43(30-11-9-8-10-12-30)42-36(29)27-13-16-31(17-14-27)50-20-19-24(2)3/h8-18,21-24,37H,7,19-20H2,1-6H3/b34-22-
InChIKey
ZVSATJAHZWZTLT-VQNDASPWSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)OCCC(C)C)C6=CC=CC=C6)S2)C
ethyl(2Z)5(4(acetyloxy)3methoxyphenyl)7methyl2((3(4(3methylbutoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ACETYLOXY3METHOXYPHENYL)7METHYL2((3(4(3METHYLBUTOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC40H40N4O7Sc174939(47)3525(4)414044(37(35)28151832(5126(5)45)33(2128)486)38(46)34(5240)22292343(301198101230)4236(29)27131631(171427)50201924(2)3h818212437H71920H216H3b3422
MFCD03462412
ZINC000097946286
ZINC000097946287

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Available files

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