Vitas-M small molecule compound
4-ethyl-3-[(3-methylbenzyl)sulfanyl]-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STK468093
SMILES CCn1c(SCc2cccc(c2)C)nnc1c1cc(OC)c(c(c1)OC)OC
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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 C21H25N3O3S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3S/c1-6-24-20(16-11-17(25-3)19(27-5)18(12-16)26-4)22-23-21(24)28-13-15-9-7-8-14(2)10-15/h7-12H,6,13H2,1-5H3InChIKey
XDEUPZNOLRUWIN-UHFFFAOYSA-NSynonyms
4ethyl3((3methylbenzyl)sulfanyl)5(345trimethoxyphenyl)4H124triazole
4ethyl3((3methylphenyl)methylsulfanyl)5(345trimethoxyphenyl)124triazole
5(4ETHYL5((3METHYLPHENYL)METHYLTHIO)(124TRIAZOL3YL))123TRIMETHOXYBENZENE
CCN1C(=NN=C1SCC2=CC=CC(=C2)C)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC21H25N3O3Sc162420(161117(253)19(275)18(1216)264)222321(24)28131597814(2)1015h712H613H215H3
MFCD06143394
ZINC000017081737
ZINC17081737
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