Vitas-M small molecule compound
N-(2-bromo-4,5-dimethylphenyl)-2-({5-[3-(2,4-dichlorophenoxy)propyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK137379
SMILES O=C(Nc1cc(C)c(cc1Br)C)CSc1nnc(n1C)CCCOc1ccc(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 C22H23BrCl2N4O2S MW 558.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrCl2N4O2S/c1-13-9-16(23)18(10-14(13)2)26-21(30)12-32-22-28-27-20(29(22)3)5-4-8-31-19-7-6-15(24)11-17(19)25/h6-7,9-11H,4-5,8,12H2,1-3H3,(H,26,30)InChIKey
DBIGQGAAKQZYGP-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1C)Br)NC(=O)CSC2=NN=C(N2C)CCCOC3=C(C=C(C=C3)Cl)Cl
InChI=1SC22H23BrCl2N4O2Sc113916(23)18(1014(13)2)2621(30)123222282720(29(22)3)54831197615(24)1117(19)25h67911H45812H213H3(H2630)
MFCD04374598
N(2BROMO45DIMETHYLPHENYL)2((5(3(24DICHLOROPHENOXY)PROPYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2BROMO45DIMETHYLPHENYL)2((5(3(24DICHLOROPHENOXY)PROPYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002861134
ZINC2861134
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