Vitas-M small molecule compound
2-{4-ethyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}-N-(4-methoxyphenyl)acetamide
Catalog ID
STK245708
SMILES COc1ccc(cc1)NC(=O)Cc1nnc(n1CC)SCc1cccc(c1)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 C21H24N4O2S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S/c1-4-25-19(13-20(26)22-17-8-10-18(27-3)11-9-17)23-24-21(25)28-14-16-7-5-6-15(2)12-16/h5-12H,4,13-14H2,1-3H3,(H,22,26)InChIKey
CLAYIPOQNQXDPT-UHFFFAOYSA-NSynonyms
2(4ETHYL5((3METHYLBENZYL)SULFANYL)4H124TRIAZOL3YL)N(4METHOXYPHENYL)ACETAMIDE
2(4ethyl5((3methylphenyl)methylsulfanyl)124triazol3yl)N(4methoxyphenyl)acetamide
2(4ETHYL5(3METHYLBENZYLSULFANYL)4H(124)TRIAZOL3YL)N(4METHOXYPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC2=CC=CC(=C2)C)CC(=O)NC3=CC=C(C=C3)OC
InChI=1SC21H24N4O2Sc142519(1320(26)221781018(273)11917)232421(25)28141675615(2)1216h512H41314H213H3(H2226)
MFCD08670388
ZINC000009327874
ZINC09327874
ZINC9327874
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