Vitas-M small molecule compound
N-[(E)-{5-[(3-chloro-2-methylphenoxy)methyl]furan-2-yl}methylidene]-3-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173425
SMILES CSc1nnc(n1/N=C/c1ccc(o1)COc1cccc(c1C)Cl)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 C17H17ClN4O2S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2S/c1-11-15(18)5-4-6-16(11)23-10-14-8-7-13(24-14)9-19-22-12(2)20-21-17(22)25-3/h4-9H,10H2,1-3H3/b19-9+InChIKey
IWTALNMMTLONRJ-DJKKODMXSA-NSynonyms
866742-22-5(E)1(5((3chloro2methylphenoxy)methyl)furan2yl)N(3methyl5methylsulfanyl124triazol4yl)methanimine
866742225
CC1=C(C=CC=C1Cl)OCC2=CC=C(O2)C=NN3C(=NN=C3SC)C
CSc1nnc(n1N=Cc1ccc(o1)COc1cccc(c1C)Cl)C
InChI=1SC17H17ClN4O2Sc11115(18)54616(11)2310148713(2414)9192212(2)202117(22)253h49H10H213H3b199+
MFCD06196055
N((E)(5((3chloro2methylphenoxy)methyl)furan2yl)methylidene)3methyl5(methylsulfanyl)4H124triazol4amine
ZINC000036611471
ZINC96569485
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