Vitas-M small molecule compound
N-(5-chloro-2-hydroxyphenyl)-2-({5-[(2,4-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK273980
SMILES CCn1c(SCC(=O)Nc2cc(Cl)ccc2O)nnc1COc1ccc(cc1C)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 C21H23ClN4O3S MW 446.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O3S/c1-4-26-19(11-29-18-8-5-13(2)9-14(18)3)24-25-21(26)30-12-20(28)23-16-10-15(22)6-7-17(16)27/h5-10,27H,4,11-12H2,1-3H3,(H,23,28)InChIKey
KKVOLFUDYPZJBN-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)O)COC3=C(C=C(C=C3)C)C
InChI=1SC21H23ClN4O3Sc142619(1129188513(2)914(18)3)242521(26)301220(28)23161015(22)6717(16)27h51027H41112H213H3(H2328)
MFCD09268290
N(5chloro2hydroxyphenyl)2((5((24dimethylphenoxy)methyl)4ethyl124triazol3yl)sulfanyl)acetamide
N(5CHLORO2HYDROXYPHENYL)2((5((24DIMETHYLPHENOXY)METHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000009615058
ZINC09615058
ZINC9615058
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