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

CAS No.
539809-29-5
CCD No.
CCD00391643
Formula
C25 H21 F3 N4 O S2
MolWeight
514.594

Basic Information

Product Name: 2-[(5-[[(4-METHYLPHENYL)SULFANYL]METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]-N-[2-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
CAS: 539809-29-5
English Synonyms: 2-[(5-[[(4-METHYLPHENYL)SULFANYL]METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]-N-[2-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
MDL Number.: MFCD03460746
H bond acceptor: 5
H bond donor: 1
Smile: Cc1ccc(cc1)SCc2nnc(n2c3ccccc3)SCC(=O)Nc4ccccc4C(F)(F)F
InChi: InChI=1S/C25H21F3N4OS2/c1-17-11-13-19(14-12-17)34-15-22-30-31-24(32(22)18-7-3-2-4-8-18)35-16-23(33)29-21-10-6-5-9-20(21)25(26,27)28/h2-14H,15-16H2,1H3,(H,29,33)
InChiKey: InChIKey=NVNHOEBRNDQSKL-UHFFFAOYSA-N

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