Vitas-M small molecule compound
ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[3-iodo-5-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522640
SMILES C=CCOc1c(I)cc(cc1OC)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc2c(c1)OCO2)C(=O)OCC)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 C28H25IN2O7S MW 660.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25IN2O7S/c1-5-9-36-25-18(29)10-16(11-21(25)34-4)12-22-26(32)31-24(17-7-8-19-20(13-17)38-14-37-19)23(27(33)35-6-2)15(3)30-28(31)39-22/h5,7-8,10-13,24H,1,6,9,14H2,2-4H3/b22-12-InChIKey
PKZLYIGHESPTFS-UUYOSTAYSA-NSynonyms
C=CCOc1c(I)cc(cc1OC)C=c1sc2=NC(=C(C(n2c1=O)c1ccc2c(c1)OCO2)C(=O)OCC)C
CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)C(=CC5=CC(=C(C(=C5)I)OCC=C)OC)S2)C
ETHYL(2Z)5(13BENZODIOXOL5YL)2((3IODO5METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(13benzodioxol5yl)2(3iodo5methoxy4(prop2en1yloxy)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC28H25IN2O7Sc159362518(29)1016(1121(25)344)122226(32)3124(17781920(1317)38143719)23(27(33)3562)15(3)3028(31)3922h578101324H16914H224H3b2212
MFCD02378740
ZINC000150439118
ZINC000150439122
Check stock
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Check stock on Vitas-MAvailable files
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