Vitas-M small molecule compound

(4E)-4-{hydroxy[3-methyl-4-(propan-2-yloxy)phenyl]methylidene}-1-[2-(morpholin-4-yl)ethyl]-5-(4-nitrophenyl)pyrrolidine-2,3-dione

Catalog ID
STK612486
SMILES CC(Oc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CCN1CCOCC1)/O)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 C27H31N3O7 MW 509.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O7/c1-17(2)37-22-9-6-20(16-18(22)3)25(31)23-24(19-4-7-21(8-5-19)30(34)35)29(27(33)26(23)32)11-10-28-12-14-36-15-13-28/h4-9,16-17,24,31H,10-15H2,1-3H3/b25-23+
InChIKey
SKZOQIXYTISWAD-WJTDDFOZSA-N
Synonyms
371138-42-0
(4E)4(hydroxy(3methyl4(propan2yloxy)phenyl)methylidene)1(2(morpholin4yl)ethyl)5(4nitrophenyl)pyrrolidine23dione
(4E)4(HYDROXY(3METHYL4PROPAN2YLOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(4NITROPHENYL)PYRROLIDINE23DIONE
371138420
CC(Oc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)(N+)(=O)(O))CCN1CCOCC1)O)C
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=C(C=C4)(N+)(=O)(O))O)OC(C)C
InChI=1SC27H31N3O7c117(2)37229620(1618(22)3)25(31)2324(194721(8519)30(34)35)29(27(33)26(23)32)111028121436151328h4916172431H1015H213H3b2523+
MFCD08730834
ZINC000102377704
ZINC000102377708

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Available files

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