Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Catalog ID
STL044496
SMILES CCOc1ccc(cc1)/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/c1-5-35-21-12-10-20(11-13-21)26(32)23-25(19-8-6-16(2)7-9-19)31(28(34)27(23)33)29-30-24-18(4)14-17(3)15-22(24)36-29/h6-15,25,32H,5H2,1-4H3/b26-23+InChIKey
UEGOOWSSRFBBPK-WNAAXNPUSA-NSynonyms
514194-38-8(4E)1(46dimethyl13benzothiazol2yl)4((4ethoxyphenyl)(hydroxy)methylidene)5(4methylphenyl)pyrrolidine23dione
(4E)1(46DIMETHYL13BENZOTHIAZOL2YL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(4METHYLPHENYL)PYRROLIDINE23DIONE
1(46DIMETHYLBENZOTHIAZOL2YL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY5(4METHYLPHENYL)3PYRROLIN2ONE
514194388
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(C=C(C=C4S3)C)C)C5=CC=C(C=C5)C)O
CCOc1ccc(cc1)C(=C1C(c2ccc(cc2)C)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)C)O
InChI=1SC29H26N2O4Sc153521121020(111321)26(32)2325(198616(2)7919)31(28(34)27(23)33)29302418(4)1417(3)1522(24)3629h6152532H5H214H3b2623+
MFCD03815161
ZINC000102875012
ZINC000102875014
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