Vitas-M small molecule compound
N-[(E)-(2-bromophenyl)methylidene]-3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STK314762
SMILES CCCCSc1nnc(n1/N=C/c1ccccc1Br)C(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 C14H15BrF2N4S MW 389.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15BrF2N4S/c1-2-3-8-22-14-20-19-13(12(16)17)21(14)18-9-10-6-4-5-7-11(10)15/h4-7,9,12H,2-3,8H2,1H3/b18-9+InChIKey
ZHJJTYDMLFTYAP-GIJQJNRQSA-NSynonyms
866815-16-9(E)1(2bromophenyl)N(3butylsulfanyl5(difluoromethyl)124triazol4yl)methanimine
866815169
CCCCSC1=NN=C(N1N=CC2=CC=CC=C2Br)C(F)F
CCCCSc1nnc(n1N=Cc1ccccc1Br)C(F)F
InChI=1SC14H15BrF2N4Sc12382214201913(12(16)17)21(14)18910645711(10)15h47912H238H21H3b189+
MFCD06197267
N((E)(2bromophenyl)methylidene)3(butylsulfanyl)5(difluoromethyl)4H124triazol4amine
ZINC000013961091
ZINC59847575
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