Vitas-M small molecule compound

2-{3,4,5,6-tetrahydro-2H-azepin-7-yl[3-(trifluoromethyl)phenyl]amino}-1-(thiophen-2-yl)ethanone

Catalog ID
STL229221
SMILES O=C(c1cccs1)CN(c1cccc(c1)C(F)(F)F)C1=NCCCCC1

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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 C19H19F3N2OS MW 380.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19F3N2OS/c20-19(21,22)14-6-4-7-15(12-14)24(18-9-2-1-3-10-23-18)13-16(25)17-8-5-11-26-17/h4-8,11-12H,1-3,9-10,13H2
InChIKey
LJXIJTLBINJMCE-UHFFFAOYSA-N
Synonyms

2(3456tetrahydro2Hazepin7yl(3(trifluoromethyl)phenyl)amino)1(thiophen2yl)ethanone
2(N(3456tetrahydro2Hazepin7yl)3(trifluoromethyl)anilino)1thiophen2ylethanone
C1CCC(=NCC1)N(CC(=O)C2=CC=CS2)C3=CC=CC(=C3)C(F)(F)F
InChI=1SC19H19F3N2OSc2019(2122)1464715(1214)24(189213102318)1316(25)1785112617h481112H1391013H2
MFCD06735979
ZINC000008418296
ZINC8418296

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Available files

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