Vitas-M small molecule compound

2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)acetamide

Catalog ID
STK743958
SMILES O=C(Nc1c(C)ccc2c1nsn2)CN1CCN(CC1)c1ccc(cc1)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 C19H20FN5OS MW 385.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FN5OS/c1-13-2-7-16-19(23-27-22-16)18(13)21-17(26)12-24-8-10-25(11-9-24)15-5-3-14(20)4-6-15/h2-7H,8-12H2,1H3,(H,21,26)
InChIKey
TUXUNIYSIRVMCX-UHFFFAOYSA-N
Synonyms
838871-49-1
2(4(4fluorophenyl)piperazin1yl)N(5methyl213benzothiadiazol4yl)acetamide
2(4(4fluorophenyl)piperazin1yl)N(5methylbenzo(c)(125)thiadiazol4yl)acetamide
838871491
CC1=C(C2=NSN=C2C=C1)NC(=O)CN3CCN(CC3)C4=CC=C(C=C4)F
InChI=1SC19H20FN5OSc113271619(23272216)18(13)2117(26)122481025(11924)155314(20)4615h27H812H21H3(H2126)
MFCD06617036
ZINC000055242737
ZINC55242737

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Available files

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