Vitas-M small molecule compound

N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-4-cyano-2-fluorobenzamide

Catalog ID
STK231650
SMILES N#Cc1ccc(c(c1)F)C(=O)Nc1cc(ccc1OC)c1nc2c(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 C22H14FN3O2S MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14FN3O2S/c1-28-19-9-7-14(22-26-17-4-2-3-5-20(17)29-22)11-18(19)25-21(27)15-8-6-13(12-24)10-16(15)23/h2-11H,1H3,(H,25,27)
InChIKey
ZONXMJZDINPXNO-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4=C(C=C(C=C4)C#N)F
InChI=1SC22H14FN3O2Sc128199714(222617423520(17)2922)1118(19)2521(27)158613(1224)1016(15)23h211H1H3(H2527)
MFCD06752288
N(5(13benzothiazol2yl)2methoxyphenyl)4cyano2fluorobenzamide
N(5BENZOTHIAZOL2YL2METHOXYPHENYL)4CYANO2FLUOROBENZAMIDE
ZINC000004487762
ZINC04487762
ZINC4487762

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Available files

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