Vitas-M small molecule compound

(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(thiophen-2-yl)pyrrolidine-2,3-dione

Catalog ID
STL052700
SMILES CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)c1nc2c(s1)cc(cc2)Cl)/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 C25H17ClN2O4S2 MW 509.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClN2O4S2/c1-12-9-14-10-13(4-7-17(14)32-12)22(29)20-21(18-3-2-8-33-18)28(24(31)23(20)30)25-27-16-6-5-15(26)11-19(16)34-25/h2-8,10-12,21,29H,9H2,1H3/b22-20+
InChIKey
NOBWSQFCHBHUCV-LSDHQDQOSA-N
Synonyms
862193-10-0
(4E)1(6chloro13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(thiophen2yl)pyrrolidine23dione
(4E)1(6CHLORO13BENZOTHIAZOL2YL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5THIOPHEN2YLPYRROLIDINE23DIONE
862193100
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)Cl)C6=CC=CS6)O
CC1Oc2c(C1)cc(cc2)C(=C1C(=O)C(=O)N(C1c1cccs1)c1nc2c(s1)cc(cc2)Cl)O
InChI=1SC25H17ClN2O4S2c1129141013(4717(14)3212)22(29)2021(183283318)28(24(31)23(20)30)2527166515(26)1119(16)3425h2810122129H9H21H3b2220+
MFCD05724479
ZINC000102771542
ZINC000102771547

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Available files

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