Vitas-M small molecule compound
(4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Catalog ID
STL050556
SMILES CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)c1nc2c(s1)cc(cc2)F)/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 C30H25FN2O4S MW 528.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25FN2O4S/c1-15(2)17-4-6-18(7-5-17)26-25(27(34)19-8-11-23-20(13-19)12-16(3)37-23)28(35)29(36)33(26)30-32-22-10-9-21(31)14-24(22)38-30/h4-11,13-16,26,34H,12H2,1-3H3/b27-25+InChIKey
QWAFOVOHNLWIFG-IMVLJIQESA-NSynonyms
877646-80-5(4E)1(6fluoro13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(4(propan2yl)phenyl)pyrrolidine23dione
(4E)1(6FLUORO13BENZOTHIAZOL2YL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
877646805
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)F)C6=CC=C(C=C6)C(C)C)O
CC1Oc2c(C1)cc(cc2)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)c1nc2c(s1)cc(cc2)F)O
InChI=1SC30H25FN2O4Sc115(2)174618(7517)2625(27(34)198112320(1319)1216(3)3723)28(35)29(36)33(26)30322210921(31)1424(22)3830h41113162634H12H213H3b2725+
MFCD05731146
ZINC000102770937
ZINC000102770945
Check stock
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Check stock on Vitas-MAvailable files
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