Vitas-M small molecule compound
(4E)-4-[hydroxy(phenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STL047376
SMILES COc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccccc2)\O)/C(=O)C1=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 C25H17N3O6S MW 487.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O6S/c1-34-17-10-11-18-19(13-17)35-25(26-18)27-21(15-8-5-9-16(12-15)28(32)33)20(23(30)24(27)31)22(29)14-6-3-2-4-7-14/h2-13,21,29H,1H3/b22-20+InChIKey
PIFWZVRORQEISB-LSDHQDQOSA-NSynonyms
514186-61-9(4E)4(hydroxy(phenyl)methylidene)1(6methoxy13benzothiazol2yl)5(3nitrophenyl)pyrrolidine23dione
3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)5(3NITROPHENYL)4(PHENYLCARBONYL)3PYRROLIN2ONE
514186619
COC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=CC=C4)O)C(=O)C3=O)C5=CC(=CC=C5)(N+)(=O)(O)
COc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)(N+)(=O)(O))C(=C(c2ccccc2)O)C(=O)C1=O
InChI=1SC25H17N3O6Sc1341710111819(1317)3525(2618)2721(1585916(1215)28(32)33)20(23(30)24(27)31)22(29)146324714h2132129H1H3b2220+
MFCD03799805
ZINC000102883057
ZINC000102883060
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