Vitas-M small molecule compound

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

Catalog ID
STL054943
SMILES CC1Cc2c(O1)ccc(c2)/C(=C\1/C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)F)/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 C34H25FN2O5S MW 592.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25FN2O5S/c1-19-14-23-15-22(10-13-27(23)42-19)31(38)29-30(21-8-5-9-25(16-21)41-18-20-6-3-2-4-7-20)37(33(40)32(29)39)34-36-26-12-11-24(35)17-28(26)43-34/h2-13,15-17,19,30,38H,14,18H2,1H3/b31-29+
InChIKey
MVXYYBMZRJUPNX-OWWNRXNESA-N
Synonyms
877802-30-7
(4E)1(6FLUORO13BENZOTHIAZOL2YL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(3PHENYLMETHOXYPHENYL)PYRROLIDINE23DIONE
(4E)5(3(benzyloxy)phenyl)1(6fluoro13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
877802307
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)F)C6=CC(=CC=C6)OCC7=CC=CC=C7)O
CC1Cc2c(O1)ccc(c2)C(=C1C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)F)O
InChI=1SC34H25FN2O5Sc11914231522(101327(23)4219)31(38)2930(2185925(1621)4118206324720)37(33(40)32(29)39)343626121124(35)1728(26)4334h2131517193038H1418H21H3b3129+
MFCD05731911
ZINC000102735561
ZINC000102735567

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Available files

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