Vitas-M small molecule compound

methyl 4-(1,3-benzothiazol-2-yl)butanoate

Catalog ID
STK842501
SMILES COC(=O)CCCc1nc2c(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/c1-15-12(14)8-4-7-11-13-9-5-2-3-6-10(9)16-11/h2-3,5-6H,4,7-8H2,1H3
InChIKey
PETPIBQKDRRSJT-UHFFFAOYSA-N
Synonyms
100192-34-5
100192345
4(13BENZOTHIAZOL2YL)BUTANOICACIDMETHYLESTER
4(13BENZOTHIAZOL2YL)BUTYRICACIDMETHYLESTER
COC(=O)CCCC1=NC2=CC=CC=C2S1
InChI=1SC12H13NO2Sc11512(14)84711139523610(9)1611h2356H478H21H3
methyl4(13benzothiazol2yl)butanoate
METHYL4(2BENZOTHIAZOLYL)BUTANOATE
METHYL4(BENZO(D)THIAZOL2YL)BUTANOATE
METHYL4BENZOTHIAZOL2YLBUTANOATE
MFCD03469381
ZINC000000529131
ZINC00529131
ZINC529131

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Available files

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