Vitas-M small molecule compound
ethyl (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK698428
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)/c(=C/c1ccc3c(c1)OCO3)/s2
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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 C29H24N2O6S MW 528.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O6S/c1-4-35-28(33)24-16(2)30-29-31(26(24)25-19-8-6-5-7-18(19)10-12-21(25)34-3)27(32)23(38-29)14-17-9-11-20-22(13-17)37-15-36-20/h5-14,26H,4,15H2,1-3H3/b23-14-InChIKey
YUXSOOZNCQNJEV-UCQKPKSFSA-NSynonyms
(Z)ethyl2(benzo(d)(13)dioxol5ylmethylene)5(2methoxynaphthalen1yl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)c(=Cc1ccc3c(c1)OCO3)s2
CCOC(=O)C1=C(N=C2N(C1C3=C(C=CC4=CC=CC=C43)OC)C(=O)C(=CC5=CC6=C(C=C5)OCO6)S2)C
ethyl(2Z)2(13benzodioxol5ylmethylidene)5(2methoxynaphthalen1yl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)5(2METHOXYNAPHTHALEN1YL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H24N2O6Sc143528(33)2416(2)302931(26(24)2519865718(19)101221(25)343)27(32)23(3829)14179112022(1317)37153620h51426H415H213H3b2314
MFCD01593120
ZINC000002189844
ZINC000100618514
Check stock
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Check stock on Vitas-MAvailable files
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