Vitas-M small molecule compound

N-(1,1,1,3,3,3-hexafluoro-2-{[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amino}propan-2-yl)-3-methoxybenzamide

Catalog ID
STK679512
SMILES COc1cccc(c1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1nc2c(s1)cc(cc2)OC(F)(F)F

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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 C19H12F9N3O3S MW 533.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F9N3O3S/c1-33-10-4-2-3-9(7-10)14(32)30-16(17(20,21)22,18(23,24)25)31-15-29-12-6-5-11(8-13(12)35-15)34-19(26,27)28/h2-8H,1H3,(H,29,31)(H,30,32)
InChIKey
SAXXLTMEINDMIU-UHFFFAOYSA-N
Synonyms

COC1=CC=CC(=C1)C(=O)NC(C(F)(F)F)(C(F)(F)F)NC2=NC3=C(S2)C=C(C=C3)OC(F)(F)F
InChI=1SC19H12F9N3O3Sc133104239(710)14(32)3016(17(2021)2218(2324)25)311529126511(813(12)3515)3419(2627)28h28H1H3(H2931)(H3032)
MFCD03763672
N(111333hexafluoro2((6(trifluoromethoxy)13benzothiazol2yl)amino)propan2yl)3methoxybenzamide
ZINC000002192588
ZINC2192588

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Available files

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