Vitas-M small molecule compound
[4-(1,2-benzothiazol-3-yl)piperazin-1-yl](2-methyl-1H-indol-3-yl)acetic acid
Catalog ID
STK649701
SMILES Cc1[nH]c2c(c1C(N1CCN(CC1)c1nsc3c1cccc3)C(=O)O)cccc2
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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 C22H22N4O2S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S/c1-14-19(15-6-2-4-8-17(15)23-14)20(22(27)28)25-10-12-26(13-11-25)21-16-7-3-5-9-18(16)29-24-21/h2-9,20,23H,10-13H2,1H3,(H,27,28)InChIKey
CUFGAERXPRSDSS-UHFFFAOYSA-NSynonyms
1144445-07-7(4(12benzothiazol3yl)piperazin1yl)(2methyl1Hindol3yl)aceticacid
1144445077
2(4(12benzothiazol3yl)piperazin1yl)2(2methyl1Hindol3yl)aceticacid
2(4(benzo(d)isothiazol3yl)piperazin1yl)2(2methyl1Hindol3yl)aceticacid
Cc1(nH)c2c(c1C(N1CCN(CC1)c1nsc3c1cccc3)C(=O)O)cccc2
CC1=C(C2=CC=CC=C2N1)C(C(=O)O)N3CCN(CC3)C4=NSC5=CC=CC=C54
InChI=1SC22H22N4O2Sc11419(15624817(15)2314)20(22(27)28)25101226(131125)2116735918(16)292421h292023H1013H21H3(H2728)
MFCD12216719
ZINC000032101817
ZINC000032101820
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