Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-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
STL055815
SMILES CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)c1sc2c(n1)c(C)cc(c2)C)/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 C32H30N2O4S MW 538.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O4S/c1-16(2)20-6-8-21(9-7-20)28-26(29(35)22-10-11-24-23(15-22)14-19(5)38-24)30(36)31(37)34(28)32-33-27-18(4)12-17(3)13-25(27)39-32/h6-13,15-16,19,28,35H,14H2,1-5H3/b29-26+InChIKey
SDQVOKRJKRZQHH-PBBVDAKRSA-NSynonyms
850188-87-3(4E)1(46dimethyl13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(4(propan2yl)phenyl)pyrrolidine23dione
(4E)1(46DIMETHYL13BENZOTHIAZOL2YL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
850188873
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(C=C(C=C5S4)C)C)C6=CC=C(C=C6)C(C)C)O
CC1Oc2c(C1)cc(cc2)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)c1sc2c(n1)c(C)cc(c2)C)O
InChI=1SC32H30N2O4Sc116(2)206821(9720)2826(29(35)2210112423(1522)1419(5)3824)30(36)31(37)34(28)32332718(4)1217(3)1325(27)3932h6131516192835H14H215H3b2926+
MFCD05725019
ZINC000102770996
ZINC000102770999
Check stock
See real-time availability and sample size for STL055815 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.