Vitas-M small molecule compound
prop-2-en-1-yl 2-{(3E)-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL048756
SMILES C=CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C(=O)OC)/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C1=O
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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 C30H26N2O8S MW 574.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O8S/c1-5-12-39-29(37)26-16(3)31-30(41-26)32-23(17-6-8-18(9-7-17)28(36)38-4)22(25(34)27(32)35)24(33)19-10-11-21-20(14-19)13-15(2)40-21/h5-11,14-15,23,33H,1,12-13H2,2-4H3/b24-22+InChIKey
OKUSCSNYTYFBFS-ZNTNEXAZSA-NSynonyms
893697-00-2893697002
C=CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C(=O)OC)C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C1=O
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC(=C(S4)C(=O)OCC=C)C)C5=CC=C(C=C5)C(=O)OC)O
InChI=1SC30H26N2O8Sc15123929(37)2616(3)3130(4126)3223(176818(9717)28(36)384)22(25(34)27(32)35)24(33)1910112120(1419)1315(2)4021h51114152333H11213H224H3b2422+
MFCD05731999
prop2en1yl2((3E)3(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)2(4(methoxycarbonyl)phenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
PROP2ENYL2((3E)3(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)2(4METHOXYCARBONYLPHENYL)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ZINC000101277628
ZINC000101277634
Check stock
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Check stock on Vitas-MAvailable files
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