Vitas-M small molecule compound
[1-(carboxymethyl)-1H-indol-3-yl][4-(phenylsulfonyl)piperazin-1-yl]acetic acid
Catalog ID
STK656475
SMILES OC(=O)Cn1cc(c2c1cccc2)C(N1CCN(CC1)S(=O)(=O)c1ccccc1)C(=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 C22H23N3O6S MW 457.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O6S/c26-20(27)15-24-14-18(17-8-4-5-9-19(17)24)21(22(28)29)23-10-12-25(13-11-23)32(30,31)16-6-2-1-3-7-16/h1-9,14,21H,10-13,15H2,(H,26,27)(H,28,29)InChIKey
MIZWBPASCCTTKR-UHFFFAOYSA-NSynonyms
1214156-77-0(1(carboxymethyl)1Hindol3yl)(4(phenylsulfonyl)piperazin1yl)aceticacid
1214156770
2(1(carboxymethyl)1Hindol3yl)2(4(phenylsulfonyl)piperazin1yl)aceticacid
2(4(benzenesulfonyl)piperazin1yl)2(1(carboxymethyl)indol3yl)aceticacid
C1CN(CCN1C(C2=CN(C3=CC=CC=C32)CC(=O)O)C(=O)O)S(=O)(=O)C4=CC=CC=C4
InChI=1SC22H23N3O6Sc2620(27)15241418(17845919(17)24)21(22(28)29)23101225(131123)32(3031)166213716h191421H101315H2(H2627)(H2829)
MFCD13758671
ZINC000036359309
ZINC000036359310
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