Vitas-M small molecule compound
(E)-[4-(dimethylsulfamoyl)phenyl]{2-(2-fluorophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK570126
SMILES [O-]/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)CCC[NH+]1CCOCC1)/c1ccc(cc1)S(=O)(=O)N(C)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 C26H30FN3O6S MW 531.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30FN3O6S/c1-28(2)37(34,35)19-10-8-18(9-11-19)24(31)22-23(20-6-3-4-7-21(20)27)30(26(33)25(22)32)13-5-12-29-14-16-36-17-15-29/h3-4,6-11,23,31H,5,12-17H2,1-2H3/b24-22+InChIKey
CIJBKHQPTFSEGT-ZNTNEXAZSA-NSynonyms
380890-07-3(E)(4(dimethylsulfamoyl)phenyl)(2(2fluorophenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4(DIMETHYLSULFAMOYL)PHENYL)(2(2FLUOROPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
(O)C(=C1C(=O)C(=O)N(C1c1ccccc1F)CCC(NH+)1CCOCC1)c1ccc(cc1)S(=O)(=O)N(C)C
380890073
4((E)(2(2FLUOROPHENYL)1(3MORPHOLIN4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)HYDROXYMETHYL)NNDIMETHYLBENZENESULFONAMIDE
CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)3CCOCC3)C4=CC=CC=C4F)(O)
InChI=1SC26H30FN3O6Sc128(2)37(3435)1910818(91119)24(31)2223(20634721(20)27)30(26(33)25(22)32)1351229141636171529h346112331H51217H212H3b2422+
MFCD18245338
ZINC000102560640
ZINC000102560650
Check stock
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Check stock on Vitas-MAvailable files
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