Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methylphenyl)methylidene]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STK565110
SMILES COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
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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 C30H28N2O6S MW 544.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O6S/c1-15-7-9-18(10-8-15)26(33)23-25(19-13-20(36-4)28(38-6)21(14-19)37-5)32(29(35)27(23)34)30-31-24-17(3)11-16(2)12-22(24)39-30/h7-14,25,33H,1-6H3/b26-23+InChIKey
CTIKGWRTKHUYCT-WNAAXNPUSA-NSynonyms
514193-73-8(4E)1(46dimethyl13benzothiazol2yl)4(hydroxy(4methylphenyl)methylidene)5(345trimethoxyphenyl)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)3HYDROXY4((4METHYLPHENYL)CARBONYL)5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
514193738
CC1=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)OC)OC)OC)O
COc1c(OC)cc(cc1OC)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC30H28N2O6Sc1157918(10815)26(33)2325(191320(364)28(386)21(1419)375)32(29(35)27(23)34)30312417(3)1116(2)1222(24)3930h7142533H16H3b2623+
MFCD03809613
ZINC000102532734
ZINC000102532741
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