Vitas-M small molecule compound
2-{[5-(2-ethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-iodophenyl)acetamide
Catalog ID
STL445348
SMILES CCOc1ccccc1c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)I
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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 C20H21IN4O2S MW 508.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21IN4O2S/c1-3-25-19(16-7-5-6-8-17(16)27-4-2)23-24-20(25)28-13-18(26)22-15-11-9-14(21)10-12-15/h5-12H,3-4,13H2,1-2H3,(H,22,26)InChIKey
XLORCZMNXFWWHG-UHFFFAOYSA-NSynonyms
2((5(2ETHOXYPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(4IODOPHENYL)ACETAMIDE
2((5(2ethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)N(4iodophenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)I)C3=CC=CC=C3OCC
InChI=1SC20H21IN4O2Sc132519(16756817(16)2742)232420(25)281318(26)221511914(21)101215h512H3413H212H3(H2226)
MFCD05842476
ZINC000002881065
ZINC02881065
ZINC2881065
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