Vitas-M small molecule compound
2-methylpropyl (2E)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798688
SMILES COc1cc(cc(c1OC)OC)/C=c\1/sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OCC(C)C)C
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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 C26H28N2O6S2 MW 528.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O6S2/c1-14(2)13-34-25(30)21-15(3)27-26-28(22(21)19-8-7-9-35-19)24(29)20(36-26)12-16-10-17(31-4)23(33-6)18(11-16)32-5/h7-12,14,22H,13H2,1-6H3/b20-12+InChIKey
DZCFGOCLLAXXSL-UDWIEESQSA-NSynonyms
2methylpropyl(2E)7methyl3oxo5(thiophen2yl)2(345trimethoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
2METHYLPROPYL(2E)7METHYL3OXO5THIOPHEN2YL2((345TRIMETHOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
CC1=C(C(N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OC)OC)SC2=N1)C4=CC=CS4)C(=O)OCC(C)C
COc1cc(cc(c1OC)OC)C=c1sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OCC(C)C)C
InChI=1SC26H28N2O6S2c114(2)133425(30)2115(3)272628(22(21)198793519)24(29)20(3626)12161017(314)23(336)18(1116)325h7121422H13H216H3b2012+
MFCD03417782
ZINC000100839228
ZINC000100839229
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