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2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}acetamide

Catalog ID
STL051047
SMILES O=C(Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)nc(n1)C)CSc1nnc(n1c1ccc(cc1)C)c1ccccc1Cl

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Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C29H26ClN7O3S2 MW 620.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClN7O3S2/c1-18-8-12-22(13-9-18)37-28(24-6-4-5-7-25(24)30)34-35-29(37)41-17-27(38)33-21-10-14-23(15-11-21)42(39,40)36-26-16-19(2)31-20(3)32-26/h4-16H,17H2,1-3H3,(H,33,38)(H,31,32,36)
InChIKey
NESNFJOPSUOVMD-UHFFFAOYSA-N
Synonyms

2((5(2chlorophenyl)4(4methylphenyl)124triazol3yl)sulfanyl)N(4((26dimethylpyrimidin4yl)sulfamoyl)phenyl)acetamide
2((5(2chlorophenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(4((26dimethylpyrimidin4yl)sulfamoyl)phenyl)acetamide
2((5(2chlorophenyl)4(ptolyl)4H124triazol3yl)thio)N(4(N(26dimethylpyrimidin4yl)sulfamoyl)phenyl)acetamide
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC(=NC(=C4)C)C)C5=CC=CC=C5Cl
InChI=1SC29H26ClN7O3S2c11881222(13918)3728(24645725(24)30)343529(37)411727(38)3321101423(151121)42(3940)36261619(2)3120(3)3226h416H17H213H3(H3338)(H313236)
MFCD07197841
N(4(((26DIMETHYLPYRIMIDIN4YL)AMINO)SULFONYL)PHENYL)2(5(2CHLOROPHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000097958346
ZINC97958346

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Available files

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