Vitas-M small molecule compound

N-(1,3-benzothiazol-2-yl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanamide

Catalog ID
STK540629
SMILES O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1nc2c(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 C14H5F13N2OS MW 496.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H5F13N2OS/c15-9(16,7(30)29-8-28-5-3-1-2-4-6(5)31-8)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)27/h1-4H,(H,28,29,30)
InChIKey
HOVFUPWXMYCONS-UHFFFAOYSA-N
Synonyms

C1=CC=C2C(=C1)N=C(S2)NC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI=1SC14H5F13N2OSc159(167(30)29828531246(5)318)10(1718)11(1920)12(2122)13(2324)14(2526)27h14H(H282930)
MFCD00331437
N(13benzothiazol2yl)2233445566777tridecafluoroheptanamide
N(benzo(d)thiazol2yl)2233445566777tridecafluoroheptanamidehydrate
O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1nc2c(s1)cccc2O
ZINC000097953852
ZINC97953852

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Available files

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