Vitas-M small molecule compound
ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-(4-hydroxy-3,5-dimethoxybenzylidene)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL164275
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/c1cc(OC)c(c(c1)OC)O)/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 C31H26N2O8S MW 586.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O8S/c1-4-39-30(36)25-26(18-8-6-5-7-9-18)32-31-33(27(25)19-10-11-20-21(15-19)41-16-40-20)29(35)24(42-31)14-17-12-22(37-2)28(34)23(13-17)38-3/h5-15,27,34H,4,16H2,1-3H3/b24-14-InChIKey
XCOGTEDZJXWNIR-OYKKKHCWSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1ccc3c(c1)OCO3)c(=O)c(=Cc1cc(OC)c(c(c1)OC)O)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)C(=CC5=CC(=C(C(=C5)OC)O)OC)S2)C6=CC=CC=C6
ethyl(2Z)5(13benzodioxol5yl)2((4hydroxy35dimethoxyphenyl)methylidene)3oxo7phenyl5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(13benzodioxol5yl)2(4hydroxy35dimethoxybenzylidene)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC31H26N2O8Sc143930(36)2526(188657918)323133(27(25)1910112021(1519)41164020)29(35)24(4231)14171222(372)28(34)23(1317)383h5152734H416H213H3b2414
MFCD20731799
ZINC000002162747
ZINC000002162753
Check stock
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