Vitas-M small molecule compound
1-benzyl-3-{carboxy[4-(methylsulfonyl)piperazin-1-yl]methyl}-1H-indole-2-carboxylic acid
Catalog ID
STK940884
SMILES OC(=O)C(c1c2ccccc2n(c1C(=O)O)Cc1ccccc1)N1CCN(CC1)S(=O)(=O)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 C23H25N3O6S MW 471.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O6S/c1-33(31,32)25-13-11-24(12-14-25)20(22(27)28)19-17-9-5-6-10-18(17)26(21(19)23(29)30)15-16-7-3-2-4-8-16/h2-10,20H,11-15H2,1H3,(H,27,28)(H,29,30)InChIKey
JDFINFTULCBKMN-UHFFFAOYSA-NSynonyms
1214832-20-81214832208
1benzyl3(carboxy(4(methylsulfonyl)piperazin1yl)methyl)1Hindole2carboxylicacid
1benzyl3(carboxy(4methylsulfonylpiperazin1yl)methyl)indole2carboxylicacid
CS(=O)(=O)N1CCN(CC1)C(C2=C(N(C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)O)C(=O)O
InChI=1SC23H25N3O6Sc133(3132)25131124(121425)20(22(27)28)19179561018(17)26(21(19)23(29)30)15167324816h21020H1115H21H3(H2728)(H2930)
MFCD13758821
ZINC000036359500
ZINC000036359501
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