Vitas-M small molecule compound
prop-2-en-1-yl 5-[4-(acetyloxy)-3-ethoxyphenyl]-2,7-dimethyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK704554
SMILES C=CCOC(=O)C1=C(C)N=C2N(C1c1ccc(c(c1)OCC)OC(=O)C)C(=O)C(S2)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 C22H24N2O6S MW 444.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O6S/c1-6-10-29-21(27)18-12(3)23-22-24(20(26)13(4)31-22)19(18)15-8-9-16(30-14(5)25)17(11-15)28-7-2/h6,8-9,11,13,19H,1,7,10H2,2-5H3InChIKey
IUQTVIXPVFBHHM-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(S3)C)C)C(=O)OCC=C)OC(=O)C
InChI=1SC22H24N2O6Sc16102921(27)1812(3)232224(20(26)13(4)3122)19(18)158916(3014(5)25)17(1115)2872h689111319H1710H225H3
MFCD06285212
prop2en1yl5(4(acetyloxy)3ethoxyphenyl)27dimethyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL5(4ACETYLOXY3ETHOXYPHENYL)27DIMETHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000003636895
ZINC000003636900
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