Vitas-M small molecule compound
2-{[5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenoxyethyl)acetamide
Catalog ID
STK125985
SMILES COc1cccc(c1)c1nnc(n1c1ccccc1)SCC(=O)NCCOc1ccccc1
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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 C25H24N4O3S MW 460.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S/c1-31-22-14-8-9-19(17-22)24-27-28-25(29(24)20-10-4-2-5-11-20)33-18-23(30)26-15-16-32-21-12-6-3-7-13-21/h2-14,17H,15-16,18H2,1H3,(H,26,30)InChIKey
BKXWEGVTESQFRH-UHFFFAOYSA-NSynonyms
2((5(3METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N(2PHENOXYETHYL)ACETAMIDE
2((5(3METHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N(2PHENOXYETHYL)ACETAMIDE
COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NCCOC4=CC=CC=C4
InChI=1SC25H24N4O3Sc13122148919(1722)24272825(29(24)20104251120)331823(30)2615163221126371321h21417H151618H21H3(H2630)
MFCD01239616
ZINC000003664035
ZINC03664035
ZINC3664035
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