Vitas-M small molecule compound
ethyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-[1-(2-amino-2-oxoethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798692
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\1/C(=O)N(c3c1cccc3)CC(=O)N)/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 C29H26N4O8S MW 590.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O8S/c1-5-40-28(38)22-14(2)31-29-33(24(22)16-10-11-19(41-15(3)34)20(12-16)39-4)27(37)25(42-29)23-17-8-6-7-9-18(17)32(26(23)36)13-21(30)35/h6-12,24H,5,13H2,1-4H3,(H2,30,35)/b25-23-InChIKey
SMBNAJXOFOYARQ-BZZOAKBMSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=C1C(=O)N(c3c1cccc3)CC(=O)N)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC(=O)N)S2)C
ethyl(2Z)5(4(acetyloxy)3methoxyphenyl)2(1(2amino2oxoethyl)2oxo12dihydro3Hindol3ylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(4acetyloxy3methoxyphenyl)2(1(2amino2oxoethyl)2oxoindol3ylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC29H26N4O8Sc154028(38)2214(2)312933(24(22)16101119(4115(3)34)20(1216)394)27(37)25(4229)2317867918(17)32(26(23)36)1321(30)35h61224H513H214H3(H23035)b2523
MFCD03417785
ZINC000002668513
ZINC000002668515
Check stock
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Check stock on Vitas-MAvailable files
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