Vitas-M small molecule compound
2-({5-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methylphenyl)ethanone
Catalog ID
STK267114
SMILES CCOc1cc(C)ccc1OCc1nnc(n1C)SCC(=O)c1ccc(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 C22H25N3O3S MW 411.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S/c1-5-27-20-12-16(3)8-11-19(20)28-13-21-23-24-22(25(21)4)29-14-18(26)17-9-6-15(2)7-10-17/h6-12H,5,13-14H2,1-4H3InChIKey
JYLHQAWRCMHBAZ-UHFFFAOYSA-NSynonyms
2((5((2ethoxy4methylphenoxy)methyl)4methyl124triazol3yl)sulfanyl)1(4methylphenyl)ethanone
2((5((2ETHOXY4METHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(4METHYLPHENYL)ETHANONE
2(5(2ETHOXY4METHYLPHENOXYMETHYL)4METHYL4H(124)TRIAZOL3YLSULFANYL)1PTOLYLETHANONE
CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2C)SCC(=O)C3=CC=C(C=C3)C
InChI=1SC22H25N3O3Sc1527201216(3)81119(20)281321232422(25(21)4)291418(26)179615(2)71017h612H51314H214H3
MFCD09267763
ZINC000009582624
ZINC09582624
ZINC9582624
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