Vitas-M small molecule compound
(E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}[4-(morpholin-4-ylsulfonyl)phenyl]methanolate
Catalog ID
STL040227
SMILES O=C1C(=O)/C(=C(\c2ccc(cc2)S(=O)(=O)N2CCOCC2)/[O-])/C(N1CC[NH+]1CCOCC1)c1cccs1
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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 C25H29N3O7S2 MW 547.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O7S2/c29-23(18-3-5-19(6-4-18)37(32,33)27-11-15-35-16-12-27)21-22(20-2-1-17-36-20)28(25(31)24(21)30)8-7-26-9-13-34-14-10-26/h1-6,17,22,29H,7-16H2/b23-21+InChIKey
ZDIQZBKXCUTQEL-XTQSDGFTSA-NSynonyms
371124-03-7(4E)4(HYDROXY(4MORPHOLIN4YLSULFONYLPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5THIOPHEN2YLPYRROLIDINE23DIONE
(E)(1(2(morpholin4ium4yl)ethyl)45dioxo2(thiophen2yl)pyrrolidin3ylidene)(4(morpholin4ylsulfonyl)phenyl)methanolate
(E)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2THIOPHEN2YLPYRROLIDIN3YLIDENE)(4MORPHOLIN4YLSULFONYLPHENYL)METHANOLATE
371124037
C1COCCN1CCN2C(C(=C(C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)O)C(=O)C2=O)C5=CC=CS5
InChI=1SC25H29N3O7S2c2923(183519(6418)37(3233)27111535161227)2122(2021173620)28(25(31)24(21)30)872691334141026h16172229H716H2b2321+
MFCD18247983
O=C1C(=O)C(=C(c2ccc(cc2)S(=O)(=O)N2CCOCC2)(O))C(N1CC(NH+)1CCOCC1)c1cccs1
ZINC000102865770
ZINC000102865772
Check stock
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Check stock on Vitas-MAvailable files
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