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

CAS No.
539809-49-9
CCD No.
CCD00391647
Formula
C25 H24 Cl N5 O S
MolWeight
478.018

Basic Information

Product Name: 2-([5-[(3-CHLOROANILINO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(2,5-DIMETHYLPHENYL)ACETAMIDE
CAS: 539809-49-9
English Synonyms: 2-([5-[(3-CHLOROANILINO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(2,5-DIMETHYLPHENYL)ACETAMIDE
MDL Number.: MFCD03460775
H bond acceptor: 6
H bond donor: 2
Smile: Cc1ccc(c(c1)NC(=O)CSc2nnc(n2c3ccccc3)CNc4cccc(c4)Cl)C
InChi: InChI=1S/C25H24ClN5OS/c1-17-11-12-18(2)22(13-17)28-24(32)16-33-25-30-29-23(31(25)21-9-4-3-5-10-21)15-27-20-8-6-7-19(26)14-20/h3-14,27H,15-16H2,1-2H3,(H,28,32)
InChiKey: InChIKey=NJTICZXIYSPTNP-UHFFFAOYSA-N

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