Vitas-M small molecule compound
(E)-{2-(3-bromophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(dimethylsulfamoyl)phenyl]methanolate
Catalog ID
STK569711
SMILES Brc1cccc(c1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)S(=O)(=O)N(C)C)/[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 C26H30BrN3O6S MW 592.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30BrN3O6S/c1-28(2)37(34,35)21-9-7-18(8-10-21)24(31)22-23(19-5-3-6-20(27)17-19)30(26(33)25(22)32)12-4-11-29-13-15-36-16-14-29/h3,5-10,17,23,31H,4,11-16H2,1-2H3/b24-22+InChIKey
DFLHEUULMFXPDC-ZNTNEXAZSA-NSynonyms
(E)(2(3bromophenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4(dimethylsulfamoyl)phenyl)methanolate
(E)(2(3BROMOPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4(DIMETHYLSULFAMOYL)PHENYL)METHANOLATE
4((E)(2(3BROMOPHENYL)1(3MORPHOLIN4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)HYDROXYMETHYL)NNDIMETHYLBENZENESULFONAMIDE
Brc1cccc(c1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccc(cc1)S(=O)(=O)N(C)C)(O)
CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC(=CC=C4)Br)O
InChI=1SC26H30BrN3O6Sc128(2)37(3435)219718(81021)24(31)2223(1953620(27)1719)30(26(33)25(22)32)1241129131536161429h3510172331H41116H212H3b2422+
MFCD18245317
ZINC000101101132
ZINC000101101133
Check stock
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Check stock on Vitas-MAvailable files
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