Vitas-M small molecule compound

(3E)-N-[4-chloro-2-(trifluoromethyl)phenyl]-3-[2-(thiophen-2-ylcarbonyl)hydrazinylidene]butanamide

Catalog ID
STK116085
SMILES O=C(Nc1ccc(cc1C(F)(F)F)Cl)C/C(=N/NC(=O)c1cccs1)/C

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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 C16H13ClF3N3O2S MW 403.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClF3N3O2S/c1-9(22-23-15(25)13-3-2-6-26-13)7-14(24)21-12-5-4-10(17)8-11(12)16(18,19)20/h2-6,8H,7H2,1H3,(H,21,24)(H,23,25)/b22-9+
InChIKey
ANNRWOGZFXICDL-LSFURLLWSA-N
Synonyms
340219-02-5
(3E)N(4CHLORO2(TRIFLUOROMETHYL)PHENYL)3(2(THIOPHEN2YLCARBONYL)HYDRAZINYLIDENE)BUTANAMIDE
(3E)N(4CHLORO2(TRIFLUOROMETHYL)PHENYL)3METHYL4(2THIENYLCARBONYLAMINO)4AZABUT3ENAMIDE
(E)N(4chloro2(trifluoromethyl)phenyl)3(2(thiophene2carbonyl)hydrazono)butanamide
340219025
CC(=NNC(=O)C1=CC=CS1)CC(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F
InChI=1SC16H13ClF3N3O2Sc19(222315(25)133262613)714(24)21125410(17)811(12)16(1819)20h268H7H21H3(H2124)(H2325)b229+
MFCD03036932
N((E)(4(4chloro2(trifluoromethyl)anilino)4oxobutan2ylidene)amino)thiophene2carboxamide
N(4CHLORO2TRIFLUOROMETHYLPHENYL)3((THIOPHENE2CARBONYL)HYDRAZONO)BUTYRAMIDE
O=C(Nc1ccc(cc1C(F)(F)F)Cl)CC(=NNC(=O)c1cccs1)C
ZINC000100851777
ZINC13138431

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Available files

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