Vitas-M small molecule compound

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

Catalog ID
STL164233
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)/c(=C/c1cccc(c1)OCC(=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 C26H24N2O7S MW 508.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O7S/c1-4-34-25(32)22-15(2)27-26-28(23(22)18-10-5-6-11-19(18)33-3)24(31)20(36-26)13-16-8-7-9-17(12-16)35-14-21(29)30/h5-13,23H,4,14H2,1-3H3,(H,29,30)/b20-13-
InChIKey
IJOMFFGZFKANAJ-MOSHPQCFSA-N
Synonyms

(3((6(ETHOXYCARBONYL)5(2METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2(3H)YLIDENE)METHYL)PHENOXY)ACETICACID
(3((Z)(6(ethoxycarbonyl)5(2methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidin2(3H)ylidene)methyl)phenoxy)aceticacid
2(3((Z)(6ETHOXYCARBONYL5(2METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)PHENOXY)ACETICACID
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)c(=Cc1cccc(c1)OCC(=O)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3OC)C(=O)C(=CC4=CC(=CC=C4)OCC(=O)O)S2)C
InChI=1SC26H24N2O7Sc143425(32)2215(2)272628(23(22)1810561119(18)333)24(31)20(3626)131687917(1216)351421(29)30h51323H414H213H3(H2930)b2013
MFCD03079974
ZINC000002049508
ZINC000002049510

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Available files

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