Vitas-M small molecule compound
[4-(1,2-benzothiazol-3-yl)piperazin-1-yl][1-(carboxymethyl)-6-fluoro-1H-indol-3-yl]acetic acid
Catalog ID
STK660022
SMILES OC(=O)Cn1cc(c2c1cc(F)cc2)C(N1CCN(CC1)c1nsc2c1cccc2)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 C23H21FN4O4S MW 468.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21FN4O4S/c24-14-5-6-15-17(12-28(13-20(29)30)18(15)11-14)21(23(31)32)26-7-9-27(10-8-26)22-16-3-1-2-4-19(16)33-25-22/h1-6,11-12,21H,7-10,13H2,(H,29,30)(H,31,32)InChIKey
KBBQVPWYDQMVBF-UHFFFAOYSA-NSynonyms
1214707-65-9(4(12benzothiazol3yl)piperazin1yl)(1(carboxymethyl)6fluoro1Hindol3yl)aceticacid
1214707659
2(4(12benzothiazol3yl)piperazin1yl)2(1(carboxymethyl)6fluoroindol3yl)aceticacid
2(4(benzo(d)isothiazol3yl)piperazin1yl)2(1(carboxymethyl)6fluoro1Hindol3yl)aceticacid
C1CN(CCN1C2=NSC3=CC=CC=C32)C(C4=CN(C5=C4C=CC(=C5)F)CC(=O)O)C(=O)O
InChI=1SC23H21FN4O4Sc2414561517(1228(1320(29)30)18(15)1114)21(23(31)32)267927(10826)2216312419(16)332522h16111221H71013H2(H2930)(H3132)
MFCD16625617
ZINC000040284811
ZINC000040284813
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