Vitas-M small molecule compound
N-(5-chloro-2-methoxyphenyl)-2-({5-[(2,6-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK124038
SMILES COc1ccc(cc1NC(=O)CSc1nnc(n1C)COc1c(C)cccc1C)Cl
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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/c1-13-6-5-7-14(2)20(13)29-11-18-24-25-21(26(18)3)30-12-19(27)23-16-10-15(22)8-9-17(16)28-4/h5-10H,11-12H2,1-4H3,(H,23,27)InChIKey
SCWHHAYCQXEOPQ-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2C)SCC(=O)NC3=C(C=CC(=C3)Cl)OC
InChI=1SC21H23ClN4O3Sc11365714(2)20(13)291118242521(26(18)3)301219(27)23161015(22)8917(16)284h510H1112H214H3(H2327)
MFCD04151104
N(5CHLORO2METHOXYPHENYL)2((5((26DIMETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(5CHLORO2METHOXYPHENYL)2((5((26DIMETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000000682103
ZINC00682103
ZINC682103
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