Vitas-M small molecule compound
(4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methylphenyl)methylidene]-5-(4-propoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STK623208
SMILES CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC
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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 C30H28N2O4S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O4S/c1-4-16-36-22-13-11-20(12-14-22)26-25(27(33)21-9-6-18(3)7-10-21)28(34)29(35)32(26)30-31-23-15-8-19(5-2)17-24(23)37-30/h6-15,17,26,33H,4-5,16H2,1-3H3/b27-25+InChIKey
IMSAIIGGCTVUKQ-IMVLJIQESA-NSynonyms
618420-36-3(4E)1(6ethyl13benzothiazol2yl)4(hydroxy(4methylphenyl)methylidene)5(4propoxyphenyl)pyrrolidine23dione
1(6ETHYLBENZOTHIAZOL2YL)3HYDROXY4((4METHYLPHENYL)CARBONYL)5(4PROPOXYPHENYL)3PYRROLIN2ONE
618420363
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)C)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)CC
CCCOc1ccc(cc1)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC
InChI=1SC30H28N2O4Sc14163622131120(121422)2625(27(33)219618(3)71021)28(34)29(35)32(26)30312315819(52)1724(23)3730h615172633H4516H213H3b2725+
MFCD09797602
ZINC000102723587
ZINC000102723590
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