Vitas-M small molecule compound
3-methyl-5-(methylsulfanyl)-N-{(E)-[5-(phenoxymethyl)furan-2-yl]methylidene}-4H-1,2,4-triazol-4-amine
Catalog ID
STL173464
SMILES CSc1nnc(n1/N=C/c1ccc(o1)COc1ccccc1)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 C16H16N4O2S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2S/c1-12-18-19-16(23-2)20(12)17-10-14-8-9-15(22-14)11-21-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3/b17-10+InChIKey
CEDOXXCTPHNKAA-LICLKQGHSA-NSynonyms
866742-48-5((5((1E)2(3METHYL5METHYLTHIO(124TRIAZOL4YL))2AZAVINYL)2FURYL)METHOXY)BENZENE
(E)N(3methyl5methylsulfanyl124triazol4yl)1(5(phenoxymethyl)furan2yl)methanimine
3methyl5(methylsulfanyl)N((E)(5(phenoxymethyl)furan2yl)methylidene)4H124triazol4amine
866742485
CC1=NN=C(N1N=CC2=CC=C(O2)COC3=CC=CC=C3)SC
CSc1nnc(n1N=Cc1ccc(o1)COc1ccccc1)C
InChI=1SC16H16N4O2Sc112181916(232)20(12)1710148915(2214)1121136435713h310H11H212H3b1710+
MFCD06196076
ZINC000008782494
ZINC103252295
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