Vitas-M small molecule compound
(3E)-3-(2-carbamothioylhydrazinylidene)-N-[4-chloro-3-(trifluoromethyl)phenyl]butanamide
Catalog ID
STK115397
SMILES O=C(C/C(=N/NC(=S)N)/C)Nc1ccc(c(c1)C(F)(F)F)Cl
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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 C12H12ClF3N4OS MW 352.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12ClF3N4OS/c1-6(19-20-11(17)22)4-10(21)18-7-2-3-9(13)8(5-7)12(14,15)16/h2-3,5H,4H2,1H3,(H,18,21)(H3,17,20,22)/b19-6+InChIKey
XIBHORBWBCFLFL-KPSZGOFPSA-NSynonyms
(3E)3(2CARBAMOTHIOYLHYDRAZINYLIDENE)N(4CHLORO3(TRIFLUOROMETHYL)PHENYL)BUTANAMIDE
(3E)3(carbamothioylhydrazinylidene)N(4chloro3(trifluoromethyl)phenyl)butanamide
(3E)4((AMINOTHIOXOMETHYL)AMINO)N(4CHLORO3(TRIFLUOROMETHYL)PHENYL)3METHYL4AZABUT3ENAMIDE
(E)3(2carbamothioylhydrazono)N(4chloro3(trifluoromethyl)phenyl)butanamide
CC(=NNC(=S)N)CC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F
InChI=1SC12H12ClF3N4OSc16(192011(17)22)410(21)187239(13)8(57)12(1415)16h235H4H21H3(H1821)(H3172022)b196+
MFCD01895344
O=C(CC(=NNC(=S)N)C)Nc1ccc(c(c1)C(F)(F)F)Cl
ZINC000004690567
ZINC13151651
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