Vitas-M small molecule compound

methyl (2Z)-5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2-(3-phenoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK794300
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/c1cccc(c1)Oc1ccccc1)/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 C30H24N2O6S MW 540.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O6S/c1-18-26(29(35)36-3)27(21-12-14-23(15-13-21)37-19(2)33)32-28(34)25(39-30(32)31-18)17-20-8-7-11-24(16-20)38-22-9-5-4-6-10-22/h4-17,27H,1-3H3/b25-17-
InChIKey
RSDMMSDWZSHDCM-UQQQWYQISA-N
Synonyms
374092-66-7
(Z)methyl5(4acetoxyphenyl)7methyl3oxo2(3phenoxybenzylidene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
374092667
CC1=C(C(N2C(=O)C(=CC3=CC(=CC=C3)OC4=CC=CC=C4)SC2=N1)C5=CC=C(C=C5)OC(=O)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1cccc(c1)Oc1ccccc1)s2
InChI=1SC30H24N2O6Sc11826(29(35)363)27(21121423(151321)3719(2)33)3228(34)25(3930(32)3118)1720871124(1620)382295461022h41727H13H3b2517
methyl(2Z)5(4(acetyloxy)phenyl)7methyl3oxo2(3phenoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)5(4ACETYLOXYPHENYL)7METHYL3OXO2((3PHENOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01951093
ZINC000002283195
ZINC000002283197

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.