Vitas-M small molecule compound
ethyl (2E)-5-(1,3-benzodioxol-5-yl)-3-oxo-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL558428
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/1\C(=O)Nc3c1cccc3)/s2)c1ccccc1
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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 C30H21N3O6S MW 551.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21N3O6S/c1-2-37-29(36)23-24(16-8-4-3-5-9-16)32-30-33(25(23)17-12-13-20-21(14-17)39-15-38-20)28(35)26(40-30)22-18-10-6-7-11-19(18)31-27(22)34/h3-14,25H,2,15H2,1H3,(H,31,34)/b26-22+InChIKey
WBDOVCLYGHGNKE-XTCLZLMSSA-NSynonyms
6265161
ethyl(2~(E))5(13benzodioxol5yl)3oxo2(2oxo1~(H)indol3ylidene)7phenyl5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(13benzodioxol5yl)3oxo2(2oxo12dihydro3Hindol3ylidene)7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)5(13BENZODIOXOL5YL)3OXO2(2OXO1HINDOL3YLIDENE)7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(13BENZODIOXOL5YL)3OXO2(2OXO12DIHYDRO3HINDOL3YLIDENE)7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H21N3O6Sc123729(36)2324(168435916)323033(25(23)1712132021(1417)39153820)28(35)26(4030)221810671119(18)3127(22)34h31425H215H21H3(H3134)b2622+
MFCD03697988
ZINC000000980622
ZINC000000980624
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