Vitas-M small molecule compound
ethyl ({5-[(2-chloro-5-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Catalog ID
STK468183
SMILES CCOC(=O)CSc1nnc(n1C)COc1cc(C)ccc1Cl
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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 C15H18ClN3O3S MW 355.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18ClN3O3S/c1-4-21-14(20)9-23-15-18-17-13(19(15)3)8-22-12-7-10(2)5-6-11(12)16/h5-7H,4,8-9H2,1-3H3InChIKey
QJHIFXJASDNGIQ-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NN=C(N1C)COC2=C(C=CC(=C2)C)Cl
ethyl((5((2chloro5methylphenoxy)methyl)4methyl4H124triazol3yl)sulfanyl)acetate
ethyl2((5((2chloro5methylphenoxy)methyl)4methyl124triazol3yl)sulfanyl)acetate
InChI=1SC15H18ClN3O3Sc142114(20)92315181713(19(15)3)82212710(2)5611(12)16h57H489H213H3
MFCD06139971
ZINC000017073548
ZINC17073548
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