2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(2,5-DIMETHYLPHENYL)ACETAMIDE

CAS No.
538337-59-6
CCD No.
CCD00412437
Formula
C26 H25 Br N4 O2 S
MolWeight
537.479

Basic Information

Product Name: 2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(2,5-DIMETHYLPHENYL)ACETAMIDE
CAS: 538337-59-6
English Synonyms: 2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(2,5-DIMETHYLPHENYL)ACETAMIDE
MDL Number.: MFCD03765052
H bond acceptor: 6
H bond donor: 1
Smile: Cc1ccc(c(c1)NC(=O)CSc2nnc(n2Cc3ccccc3)COc4ccc(cc4)Br)C
InChi: InChI=1S/C26H25BrN4O2S/c1-18-8-9-19(2)23(14-18)28-25(32)17-34-26-30-29-24(16-33-22-12-10-21(27)11-13-22)31(26)15-20-6-4-3-5-7-20/h3-14H,15-17H2,1-2H3,(H,28,32)
InChiKey: InChIKey=KUNJDCHQEGSHAO-UHFFFAOYSA-N

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