Vitas-M small molecule compound
methyl {[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STK807145
SMILES COC(=O)CSc1nnc(n1c1ccccc1)C1COc2c(O1)cccc2
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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 C19H17N3O4S MW 383.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O4S/c1-24-17(23)12-27-19-21-20-18(22(19)13-7-3-2-4-8-13)16-11-25-14-9-5-6-10-15(14)26-16/h2-10,16H,11-12H2,1H3InChIKey
IYRKFFBTFOXICO-UHFFFAOYSA-NSynonyms
496776-84-2496776842
COC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3COC4=CC=CC=C4O3
InChI=1SC19H17N3O4Sc12417(23)122719212018(22(19)137324813)161125149561015(14)2616h21016H1112H21H3
METHYL((5((2R)23DIHYDRO14BENZODIOXIN2YL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETATE
methyl((5(23dihydro14benzodioxin2yl)4phenyl4H124triazol3yl)sulfanyl)acetate
METHYL((5(23DIHYDRO14BENZODIOXIN2YL)4PHENYL4H124TRIAZOL3YL)THIO)ACETATE
METHYL2((5(23DIHYDRO14BENZODIOXIN3YL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2((5(23DIHYDROBENZO(B)(14)DIOXIN2YL)4PHENYL4H124TRIAZOL3YL)THIO)ACETATE
METHYL2(5(2H3HBENZO(E)14DIOXIN2YL)4PHENYL124TRIAZOL3YLTHIO)ACETATE
MFCD03621299
ZINC000001142471
ZINC000001142472
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