Vitas-M small molecule compound
3-(butylsulfanyl)-5-(difluoromethyl)-N-[(E)-(2-methylphenyl)methylidene]-4H-1,2,4-triazol-4-amine
Catalog ID
STK314725
SMILES CCCCSc1nnc(n1/N=C/c1ccccc1C)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 C15H18F2N4S MW 324.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18F2N4S/c1-3-4-9-22-15-20-19-14(13(16)17)21(15)18-10-12-8-6-5-7-11(12)2/h5-8,10,13H,3-4,9H2,1-2H3/b18-10+InChIKey
BKIWJPWGLUPAJC-VCHYOVAHSA-NSynonyms
866817-88-1(E)N(3butylsulfanyl5(difluoromethyl)124triazol4yl)1(2methylphenyl)methanimine
3(butylsulfanyl)5(difluoromethyl)N((E)(2methylphenyl)methylidene)4H124triazol4amine
866817881
CCCCSC1=NN=C(N1N=CC2=CC=CC=C2C)C(F)F
CCCCSc1nnc(n1N=Cc1ccccc1C)C(F)F
InChI=1SC15H18F2N4Sc13492215201914(13(16)17)21(15)181012865711(12)2h581013H349H212H3b1810+
MFCD06197019
ZINC000013961064
ZINC59847567
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