Vitas-M small molecule compound
ethyl (2E)-2-[2-(acetyloxy)benzylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK983161
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\c1ccccc1OC(=O)C)/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 C23H20N2O5S2 MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O5S2/c1-4-29-22(28)19-13(2)24-23-25(20(19)17-10-7-11-31-17)21(27)18(32-23)12-15-8-5-6-9-16(15)30-14(3)26/h5-12,20H,4H2,1-3H3/b18-12+InChIKey
QPUPZALDMBUKGX-LDADJPATSA-NSynonyms
324071-13-8(E)ethyl2(2acetoxybenzylidene)7methyl3oxo5(thiophen2yl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
2((6(ETHOXYCARBONYL)7METHYL3OXO5(2THIENYL)45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN2YLIDENE)METHYL)PHENYLACETATE
324071138
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1ccccc1OC(=O)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC=CC=C4OC(=O)C)S2)C
ethyl(2E)2((2acetyloxyphenyl)methylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(2(acetyloxy)benzylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC23H20N2O5S2c142922(28)1913(2)242325(20(19)17107113117)21(27)18(3223)1215856916(15)3014(3)26h51220H4H213H3b1812+
MFCD02669042
ZINC000008915396
ZINC000009380227
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