Vitas-M small molecule compound
(2E)-4-[{1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl}(4-sulfamoylbenzyl)amino]-4-oxobut-2-enoic acid
Catalog ID
STL069588
SMILES CCCCCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)/C=C/C(=O)O)Cc1ccc(cc1)S(=O)(=O)N
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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 C27H31N3O8S MW 557.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O8S/c1-2-3-4-5-16-38-21-10-8-20(9-11-21)30-25(32)17-23(27(30)35)29(24(31)14-15-26(33)34)18-19-6-12-22(13-7-19)39(28,36)37/h6-15,23H,2-5,16-18H2,1H3,(H,33,34)(H2,28,36,37)/b15-14+InChIKey
WZQWNLMYWJXATB-CCEZHUSRSA-NSynonyms
(2E)4((1(4(hexyloxy)phenyl)25dioxopyrrolidin3yl)(4sulfamoylbenzyl)amino)4oxobut2enoicacid
(E)4((1(4(hexyloxy)phenyl)25dioxopyrrolidin3yl)(4sulfamoylbenzyl)amino)4oxobut2enoicacid
(E)4((1(4HEXOXYPHENYL)25DIOXOPYRROLIDIN3YL)((4SULFAMOYLPHENYL)METHYL)AMINO)4OXOBUT2ENOICACID
CCCCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CC3=CC=C(C=C3)S(=O)(=O)N)C(=O)C=CC(=O)O
CCCCCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)C=CC(=O)O)Cc1ccc(cc1)S(=O)(=O)N
InChI=1SC27H31N3O8Sc1234516382110820(91121)3025(32)1723(27(30)35)29(24(31)141526(33)34)181961222(13719)39(2836)37h61523H251618H21H3(H3334)(H2283637)b1514+
MFCD01625816
ZINC000097968912
ZINC000100172363
Check stock
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Check stock on Vitas-MAvailable files
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