Vitas-M small molecule compound

3,4,5-trimethoxy-N-{[2-(trifluoromethyl)phenyl]carbamothioyl}benzamide

Catalog ID
STK021546
SMILES COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1ccccc1C(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 C18H17F3N2O4S MW 414.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F3N2O4S/c1-25-13-8-10(9-14(26-2)15(13)27-3)16(24)23-17(28)22-12-7-5-4-6-11(12)18(19,20)21/h4-9H,1-3H3,(H2,22,23,24,28)
InChIKey
BTOZUXIBBYOLNO-UHFFFAOYSA-N
Synonyms

345TRIMETHOXYN((2(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC=CC=C2C(F)(F)F
COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1ccccc1C(F)(F)F
InChI=1SC18H17F3N2O4Sc12513810(914(262)15(13)273)16(24)2317(28)2212754611(12)18(1920)21h49H13H3(H222232428)
MFCD02625134
STK021546
ZINC000002305091
ZINC02305091
ZINC2305091

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Available files

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