Vitas-M small molecule compound
ethyl (2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-5-(2-methoxynaphthalen-1-yl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK675207
SMILES CCOC(=O)C1=C(N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)/c(=C\c1cc3OCOc3cc1Br)/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 C34H25BrN2O6S MW 669.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25BrN2O6S/c1-3-41-33(39)29-30(20-10-5-4-6-11-20)36-34-37(31(29)28-22-12-8-7-9-19(22)13-14-24(28)40-2)32(38)27(44-34)16-21-15-25-26(17-23(21)35)43-18-42-25/h4-17,31H,3,18H2,1-2H3/b27-16+InChIKey
ZDMXYQSVDWNBPI-JVWAILMASA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)c(=Cc1cc3OCOc3cc1Br)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=C(C=CC4=CC=CC=C43)OC)C(=O)C(=CC5=CC6=C(C=C5Br)OCO6)S2)C7=CC=CC=C7
ethyl(2E)2((6bromo13benzodioxol5yl)methylidene)5(2methoxynaphthalen1yl)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2((6BROMO13BENZODIOXOL5YL)METHYLIDENE)5(2METHOXYNAPHTHALEN1YL)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC34H25BrN2O6Sc134133(39)2930(20105461120)363437(31(29)28221287919(22)131424(28)402)32(38)27(4434)1621152526(1723(21)35)43184225h41731H318H212H3b2716+
MFCD01571548
ZINC000150364062
ZINC000150364064
Check stock
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Check stock on Vitas-MAvailable files
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