Vitas-M small molecule compound
N-({4-ethyl-5-[(4-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)-4-methoxybenzamide
Catalog ID
STK291196
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1CC)SCc1ccc(cc1)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(13-22-20(26)17-9-11-18(27-3)12-10-17)23-24-21(25)28-14-16-7-5-15(2)6-8-16/h5-12H,4,13-14H2,1-3H3,(H,22,26)InChIKey
XIKJUPDQPQIEOI-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC2=CC=C(C=C2)C)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC21H24N4O2Sc142519(132220(26)1791118(273)121017)232421(25)2814167515(2)6816h512H41314H213H3(H2226)
MFCD09960314
N((4ethyl5((4methylbenzyl)sulfanyl)4H124triazol3yl)methyl)4methoxybenzamide
N((4ETHYL5((4METHYLPHENYL)METHYLSULFANYL)124TRIAZOL3YL)METHYL)4METHOXYBENZAMIDE
ZINC000006169112
ZINC06169112
ZINC6169112
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