Vitas-M small molecule compound
N-(2-bromo-4,5-dimethylphenyl)-2-({5-[(2,4-dichlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STL381636
SMILES O=C(Nc1cc(C)c(cc1Br)C)CSc1nnc(n1C)COc1ccc(cc1Cl)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 C20H19BrCl2N4O2S MW 530.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrCl2N4O2S/c1-11-6-14(21)16(7-12(11)2)24-19(28)10-30-20-26-25-18(27(20)3)9-29-17-5-4-13(22)8-15(17)23/h4-8H,9-10H2,1-3H3,(H,24,28)InChIKey
ZJOQOROCNCKFPX-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1C)Br)NC(=O)CSC2=NN=C(N2C)COC3=C(C=C(C=C3)Cl)Cl
InChI=1SC20H19BrCl2N4O2Sc111614(21)16(712(11)2)2419(28)103020262518(27(20)3)929175413(22)815(17)23h48H910H213H3(H2428)
MFCD06625366
N(2BROMO45DIMETHYLPHENYL)2((5((24DICHLOROPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2bromo45dimethylphenyl)2((5((24dichlorophenoxy)methyl)4methyl4H124triazol3yl)sulfanyl)acetamide
ZINC000001057111
ZINC1057111
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