Vitas-M small molecule compound

2-[2-(4-methylpiperazin-1-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]piperidine-1-carbothioamide

Catalog ID
STK625620
SMILES CN1CCN(CC1)CCC1CCCCN1C(=S)Nc1ccc(cc1)C(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 C20H29F3N4S MW 414.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29F3N4S/c1-25-12-14-26(15-13-25)11-9-18-4-2-3-10-27(18)19(28)24-17-7-5-16(6-8-17)20(21,22)23/h5-8,18H,2-4,9-15H2,1H3,(H,24,28)
InChIKey
ZXLZRVCDAJTTRE-UHFFFAOYSA-N
Synonyms
951970-85-7
2(2(4methylpiperazin1yl)ethyl)N(4(trifluoromethyl)phenyl)piperidine1carbothioamide
951970857
CN1CCN(CC1)CCC2CCCCN2C(=S)NC3=CC=C(C=C3)C(F)(F)F
InChI=1SC20H29F3N4Sc125121426(151325)119184231027(18)19(28)24177516(6817)20(2122)23h5818H24915H21H3(H2428)
MFCD09850496
ZINC000022935459
ZINC000022935462

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Available files

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