Vitas-M small molecule compound

N-(5,6-dimethyl-1,3-benzothiazol-2-yl)butanamide

Catalog ID
STK490924
SMILES CCCC(=O)Nc1sc2c(n1)cc(c(c2)C)C

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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 C13H16N2OS MW 248.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2OS/c1-4-5-12(16)15-13-14-10-6-8(2)9(3)7-11(10)17-13/h6-7H,4-5H2,1-3H3,(H,14,15,16)
InChIKey
SHGQUUGDUHJMFL-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC1=NC2=C(S1)C=C(C(=C2)C)C
InChI=1SC13H16N2OSc14512(16)1513141068(2)9(3)711(10)1713h67H45H213H3(H141516)
MFCD09778838
N(56dimethyl13benzothiazol2yl)butanamide
N(56DIMETHYLBENZOTHIAZOL2YL)BUTANAMIDE
ZINC000016580814
ZINC16580814

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Available files

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