Vitas-M small molecule compound
N-[(E)-{5-[(4-chlorophenoxy)methyl]furan-2-yl}methylidene]-3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173320
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)COc1ccc(cc1)Cl)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 C17H15ClF2N4O2S MW 412.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClF2N4O2S/c1-2-27-17-23-22-16(15(19)20)24(17)21-9-13-7-8-14(26-13)10-25-12-5-3-11(18)4-6-12/h3-9,15H,2,10H2,1H3/b21-9+InChIKey
MIOHJOWFJSHHLX-ZVBGSRNCSA-NSynonyms
866738-35-4(E)1(5((4chlorophenoxy)methyl)furan2yl)N(3(difluoromethyl)5ethylsulfanyl124triazol4yl)methanimine
866738354
CCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=CC=C(C=C3)Cl)C(F)F
CCSc1nnc(n1N=Cc1ccc(o1)COc1ccc(cc1)Cl)C(F)F
InChI=1SC17H15ClF2N4O2Sc122717232216(15(19)20)24(17)219137814(2613)1025125311(18)4612h3915H210H21H3b219+
MFCD06195979
N((E)(5((4chlorophenoxy)methyl)furan2yl)methylidene)3(difluoromethyl)5(ethylsulfanyl)4H124triazol4amine
ZINC000036611410
ZINC96569717
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