Vitas-M small molecule compound

5-(1,3-benzothiazol-2-yl)pentanoic acid

Catalog ID
STK371060
SMILES OC(=O)CCCCc1nc2c(s1)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 C12H13NO2S MW 235.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO2S/c14-12(15)8-4-3-7-11-13-9-5-1-2-6-10(9)16-11/h1-2,5-6H,3-4,7-8H2,(H,14,15)
InChIKey
HHBVTXVPGVQCOD-UHFFFAOYSA-N
Synonyms
21224-20-4
21224204
2BENZOTHIAZOLEPENTANOICACID
5(13benzothiazol2yl)pentanoicacid
5(2BENZOTHIAZOLYL)PENTANOICACID
5(BENZO(D)THIAZOL2YL)PENTANOICACID
5BENZOTHIAZOL2YLPENTANOICACID
C1=CC=C2C(=C1)N=C(S2)CCCCC(=O)O
InChI=1SC12H13NO2Sc1412(15)843711139512610(9)1611h1256H3478H2(H1415)
MFCD00449561
ZINC000002359281
ZINC2359281

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.