Vitas-M small molecule compound
ethyl 5-({6-[(E)-(2-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridin-2-yl]carbonyl}hydrazinylidene)methyl]-4,7-dimethoxy-1,3-benzodioxol-5-yl}methyl)-4,5-dihydro-1,2-oxazole-3-carboxylate
Catalog ID
STL433967
SMILES CCOC(=O)C1=NOC(C1)Cc1c(/C=N/NC(=O)c2sc3c(c2n2cccc2)c(C)cc(n3)C)c(OC)c2c(c1OC)OCO2
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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 C31H31N5O8S MW 633.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N5O8S/c1-6-41-31(38)21-13-18(44-35-21)12-19-20(25(40-5)27-26(24(19)39-4)42-15-43-27)14-32-34-29(37)28-23(36-9-7-8-10-36)22-16(2)11-17(3)33-30(22)45-28/h7-11,14,18H,6,12-13,15H2,1-5H3,(H,34,37)/b32-14+InChIKey
LTHYKQZWLOXFJC-HIWRWHBISA-NSynonyms
CCOC(=O)C1=NOC(C1)Cc1c(C=NNC(=O)c2sc3c(c2n2cccc2)c(C)cc(n3)C)c(OC)c2c(c1OC)OCO2
CCOC(=O)C1=NOC(C1)CC2=C(C(=C3C(=C2OC)OCO3)OC)C=NNC(=O)C4=C(C5=C(S4)N=C(C=C5C)C)N6C=CC=C6
ethyl5((6((E)((46dimethyl3pyrrol1ylthieno(23b)pyridine2carbonyl)hydrazinylidene)methyl)47dimethoxy13benzodioxol5yl)methyl)45dihydro12oxazole3carboxylate
ethyl5((6((E)(2((46dimethyl3(1Hpyrrol1yl)thieno(23b)pyridin2yl)carbonyl)hydrazinylidene)methyl)47dimethoxy13benzodioxol5yl)methyl)45dihydro12oxazole3carboxylate
InChI=1SC31H31N5O8Sc164131(38)211318(443521)121920(25(405)2726(24(19)394)42154327)14323429(37)2823(369781036)2216(2)1117(3)3330(22)4528h7111418H6121315H215H3(H3437)b3214+
MFCD26098210
ZINC000150417246
ZINC000150417254
Check stock
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Check stock on Vitas-MAvailable files
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