Vitas-M small molecule compound

2-(4-methylpiperidin-1-yl)-6-nitro-1,3-benzothiazole

Catalog ID
STK506850
SMILES CC1CCN(CC1)c1nc2c(s1)cc(cc2)[N+](=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 C13H15N3O2S MW 277.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O2S/c1-9-4-6-15(7-5-9)13-14-11-3-2-10(16(17)18)8-12(11)19-13/h2-3,8-9H,4-7H2,1H3
InChIKey
YLXNJROEQOEODN-UHFFFAOYSA-N
Synonyms

2(4methylpiperidin1yl)6nitro13benzothiazole
2(4METHYLPIPERIDYL)6NITROBENZOTHIAZOLE
CC1CCN(CC1)c1nc2c(s1)cc(cc2)(N+)(=O)(O)
CC1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)(N+)(=O)(O)
InChI=1SC13H15N3O2Sc194615(759)1314113210(16(17)18)812(11)1913h2389H47H21H3
MFCD01208789
ZINC000000267875
ZINC00267875
ZINC267875

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Available files

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