Vitas-M small molecule compound
(2E)-1-(2,4-dimethylphenyl)-2-({2-[(4-ethylphenyl)amino]phenyl}sulfonyl)-3-[(4-methylbenzyl)amino]prop-2-en-1-one
Catalog ID
STL133586
SMILES CCc1ccc(cc1)Nc1ccccc1S(=O)(=O)/C(=C/NCc1ccc(cc1)C)/C(=O)c1ccc(cc1C)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 C33H34N2O3S MW 538.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34N2O3S/c1-5-26-15-17-28(18-16-26)35-30-8-6-7-9-31(30)39(37,38)32(22-34-21-27-13-10-23(2)11-14-27)33(36)29-19-12-24(3)20-25(29)4/h6-20,22,34-35H,5,21H2,1-4H3/b32-22+InChIKey
LMSMCLZDAVOKIT-WEMUVCOSSA-NSynonyms
(2E)1(24dimethylphenyl)2((2((4ethylphenyl)amino)phenyl)sulfonyl)3((4methylbenzyl)amino)prop2en1one
(E)1(24dimethylphenyl)2(2(4ethylanilino)phenyl)sulfonyl3((4methylphenyl)methylamino)prop2en1one
CCC1=CC=C(C=C1)NC2=CC=CC=C2S(=O)(=O)C(=CNCC3=CC=C(C=C3)C)C(=O)C4=C(C=C(C=C4)C)C
CCc1ccc(cc1)Nc1ccccc1S(=O)(=O)C(=CNCc1ccc(cc1)C)C(=O)c1ccc(cc1C)C
InChI=1SC33H34N2O3Sc1526151728(181626)3530867931(30)39(3738)32(22342127131023(2)111427)33(36)29191224(3)2025(29)4h620223435H521H214H3b3222+
MFCD20753752
ZINC000097970883
ZINC97970883
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