Vitas-M small molecule compound
2-{[N-(4-methylphenyl)-N-{[4-(methylsulfanyl)phenyl]sulfonyl}glycyl]amino}benzoic acid
Catalog ID
STL138682
SMILES CSc1ccc(cc1)S(=O)(=O)N(c1ccc(cc1)C)CC(=O)Nc1ccccc1C(=O)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 C23H22N2O5S2 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5S2/c1-16-7-9-17(10-8-16)25(32(29,30)19-13-11-18(31-2)12-14-19)15-22(26)24-21-6-4-3-5-20(21)23(27)28/h3-14H,15H2,1-2H3,(H,24,26)(H,27,28)InChIKey
SBEDBWKXHBZZSC-UHFFFAOYSA-NSynonyms
2((2(4METHYLN(4METHYLSULFANYLPHENYL)SULFONYLANILINO)ACETYL)AMINO)BENZOICACID
2((N(4methylphenyl)N((4(methylsulfanyl)phenyl)sulfonyl)glycyl)amino)benzoicacid
CC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)O)S(=O)(=O)C3=CC=C(C=C3)SC
InChI=1SC23H22N2O5S2c1167917(10816)25(32(2930)19131118(312)121419)1522(26)2421643520(21)23(27)28h314H15H212H3(H2426)(H2728)
MFCD03991524
ZINC000002978395
ZINC2978395
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