Vitas-M small molecule compound

[3-(1,3-benzothiazol-2-yl)piperidin-1-yl](5-chloro-1H-indol-3-yl)acetic acid

Catalog ID
STL233198
SMILES Clc1ccc2c(c1)c(c[nH]2)C(N1CCCC(C1)c1nc2c(s1)cccc2)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 C22H20ClN3O2S MW 425.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O2S/c23-14-7-8-17-15(10-14)16(11-24-17)20(22(27)28)26-9-3-4-13(12-26)21-25-18-5-1-2-6-19(18)29-21/h1-2,5-8,10-11,13,20,24H,3-4,9,12H2,(H,27,28)
InChIKey
PSHCZBPSPAHRNI-UHFFFAOYSA-N
Synonyms
1081118-71-9
(3(13benzothiazol2yl)piperidin1yl)(5chloro1Hindol3yl)aceticacid
1081118719
2(3(13benzothiazol2yl)piperidin1yl)2(5chloro1Hindol3yl)aceticacid
2(3(benzo(d)thiazol2yl)piperidin1yl)2(5chloro1Hindol3yl)aceticacid
C1CC(CN(C1)C(C2=CNC3=C2C=C(C=C3)Cl)C(=O)O)C4=NC5=CC=CC=C5S4
Clc1ccc2c(c1)c(c(nH)2)C(N1CCCC(C1)c1nc2c(s1)cccc2)C(=O)O
InChI=1SC22H20ClN3O2Sc2314781715(1014)16(112417)20(22(27)28)2693413(1226)212518512619(18)2921h12581011132024H34912H2(H2728)
MFCD12209420
ZINC000020739027
ZINC000104826587

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Available files

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