Vitas-M small molecule compound
prop-2-en-1-yl 2-{(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxo-2-[3-(pentyloxy)phenyl]pyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK568365
SMILES CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)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 C32H32N2O8S MW 604.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N2O8S/c1-4-6-7-14-39-22-10-8-9-20(17-22)26-25(27(35)21-11-12-23-24(18-21)41-16-15-40-23)28(36)30(37)34(26)32-33-19(3)29(43-32)31(38)42-13-5-2/h5,8-12,17-18,26,35H,2,4,6-7,13-16H2,1,3H3/b27-25+InChIKey
NDLPCZAVICQZPR-IMVLJIQESA-NSynonyms
CCCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NC(=C(S5)C(=O)OCC=C)C
CCCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OCC=C
InChI=1SC32H32N2O8Sc1467143922108920(1722)2625(27(35)2111122324(1821)4116154023)28(36)30(37)34(26)323319(3)29(4332)31(38)421352h581217182635H24671316H213H3b2725+
MFCD05730410
prop2en1yl2((3E)3(23dihydro14benzodioxin6yl(hydroxy)methylidene)45dioxo2(3(pentyloxy)phenyl)pyrrolidin1yl)4methyl13thiazole5carboxylate
PROP2ENYL2((4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)23DIOXO5(3PENTOXYPHENYL)PYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ZINC000102652700
ZINC000102652703
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Check stock on Vitas-MAvailable files
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