Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Catalog ID
STK617298
SMILES COc1ccc(cc1C)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)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 C29H26N2O4S MW 498.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O4S/c1-15-6-8-19(9-7-15)25-23(26(32)20-10-11-21(35-5)17(3)14-20)27(33)28(34)31(25)29-30-24-18(4)12-16(2)13-22(24)36-29/h6-14,25,32H,1-5H3/b26-23+InChIKey
DEDLTKZBWBOSJO-WNAAXNPUSA-NSynonyms
618418-03-4(4E)1(46dimethyl13benzothiazol2yl)4(hydroxy(4methoxy3methylphenyl)methylidene)5(4methylphenyl)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)5(4METHYLPHENYL)3PYRROLIN2ONE
618418034
CC1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC)C)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C
COc1ccc(cc1C)C(=C1C(c2ccc(cc2)C)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)C)O
InChI=1SC29H26N2O4Sc1156819(9715)2523(26(32)20101121(355)17(3)1420)27(33)28(34)31(25)29302418(4)1216(2)1322(24)3629h6142532H15H3b2623+
MFCD08734863
ZINC000102715992
ZINC000102715995
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