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4-({4-[(Z)-{5-[4-(dimethylamino)phenyl]-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene}methyl]phenoxy}methyl)benzoic acid

Catalog ID
STL164276
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C/c1ccc(cc1)OCc1ccc(cc1)C(=O)O)/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 C33H31N3O6S MW 597.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N3O6S/c1-5-41-32(40)28-20(2)34-33-36(29(28)23-12-14-25(15-13-23)35(3)4)30(37)27(43-33)18-21-8-16-26(17-9-21)42-19-22-6-10-24(11-7-22)31(38)39/h6-18,29H,5,19H2,1-4H3,(H,38,39)/b27-18-
InChIKey
DZZGCYCFYKRHAI-IMRQLAEWSA-N
Synonyms

4((4((3OXO5(4(DIMETHYLAMINO)PHENYL)6(ETHOXYCARBONYL)7METHYL5HTHIAZOLO(32A)PYRIMIDINE2(3H)YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
4((4((Z)(5(4(dimethylamino)phenyl)6(ethoxycarbonyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidin2(3H)ylidene)methyl)phenoxy)methyl)benzoicacid
4((4((Z)(5(4(dimethylamino)phenyl)6ethoxycarbonyl7methyl3oxo5H(13)thiazolo(32a)pyrimidin2ylidene)methyl)phenoxy)methyl)benzoicacid
4((4((Z)(5(4DIMETHYLAMINOPHENYL)6ETHOXYCARBONYL7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1ccc(cc1)OCc1ccc(cc1)C(=O)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC5=CC=C(C=C5)C(=O)O)S2)C
InChI=1SC33H31N3O6Sc154132(40)2820(2)343336(29(28)23121425(151323)35(3)4)30(37)27(4333)182181626(17921)42192261024(11722)31(38)39h61829H519H214H3(H3839)b2718
MFCD20731800
ZINC000002174778
ZINC000002174780

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Available files

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