Vitas-M small molecule compound
5-({[4-(4-ethoxyphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole
Catalog ID
STL406372
SMILES CCOc1ccc(cc1)n1c(SCc2onc(n2)c2ccc(cc2)OC)nnc1C
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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 C21H21N5O3S MW 423.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O3S/c1-4-28-18-11-7-16(8-12-18)26-14(2)23-24-21(26)30-13-19-22-20(25-29-19)15-5-9-17(27-3)10-6-15/h5-12H,4,13H2,1-3H3InChIKey
DUJQGRVCJPLFSA-UHFFFAOYSA-NSynonyms
5(((4(4ethoxyphenyl)5methyl4H124triazol3yl)sulfanyl)methyl)3(4methoxyphenyl)124oxadiazole
5((4(4ethoxyphenyl)5methyl124triazol3yl)sulfanylmethyl)3(4methoxyphenyl)124oxadiazole
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=NO3)C4=CC=C(C=C4)OC)C
InChI=1SC21H21N5O3Sc14281811716(81218)2614(2)232421(26)3013192220(252919)155917(273)10615h512H413H213H3
MFCD07048912
ZINC000009409419
ZINC9409419
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