Vitas-M small molecule compound
2-({5-[(2-ethoxy-4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorophenyl)acetamide
Catalog ID
STK336193
SMILES CCOc1cc(C)ccc1OCc1nnc(n1CC=C)SCC(=O)Nc1ccc(cc1)F
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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 C23H25FN4O3S MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25FN4O3S/c1-4-12-28-21(14-31-19-11-6-16(3)13-20(19)30-5-2)26-27-23(28)32-15-22(29)25-18-9-7-17(24)8-10-18/h4,6-11,13H,1,5,12,14-15H2,2-3H3,(H,25,29)InChIKey
UPMQQIYTCWLOFO-UHFFFAOYSA-NSynonyms
2((5((2ETHOXY4METHYLPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
2((5((2ETHOXY4METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2CC=C)SCC(=O)NC3=CC=C(C=C3)F
InChI=1SC23H25FN4O3Sc14122821(14311911616(3)1320(19)3052)262723(28)321522(29)25189717(24)81018h461113H15121415H223H3(H2529)
MFCD09964567
ZINC000018201286
ZINC18201286
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