Vitas-M small molecule compound

2-butanoyl-N-[2-(trifluoromethyl)phenyl]hydrazinecarbothioamide

Catalog ID
STK444183
SMILES CCCC(=O)NNC(=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 C12H14F3N3OS MW 305.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14F3N3OS/c1-2-5-10(19)17-18-11(20)16-9-7-4-3-6-8(9)12(13,14)15/h3-4,6-7H,2,5H2,1H3,(H,17,19)(H2,16,18,20)
InChIKey
ZEEJCQJNUMLENI-UHFFFAOYSA-N
Synonyms

1(butanoylamino)3(2(trifluoromethyl)phenyl)thiourea
2butanoylN(2(trifluoromethyl)phenyl)hydrazinecarbothioamide
CCCC(=O)NNC(=S)NC1=CC=CC=C1C(F)(F)F
InChI=1SC12H14F3N3OSc12510(19)171811(20)16974368(9)12(1314)15h3467H25H21H3(H1719)(H2161820)
MFCD04055375
N((THIOXO((2(TRIFLUOROMETHYL)PHENYL)AMINO)METHYL)AMINO)BUTANAMIDE
ZINC000006389184
ZINC06389184
ZINC6389184

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Available files

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