Catalog Number:
AG01EOLH
Chemical Name:
6H05 trifluoroacetate
CAS Number:
2061344-88-3
Molecular Formula:
C22H31ClF3N3O4S3
Molecular Weight:
590.1424
IUPAC Name:
1-[2-(4-chlorophenyl)sulfanylacetyl]-N-[2-[2-(dimethylamino)ethyldisulfanyl]ethyl]piperidine-4-carboxamide;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C20H30ClN3O2S3.C2HF3O2/c1-23(2)12-14-29-28-13-9-22-20(26)16-7-10-24(11-8-16)19(25)15-27-18-5-3-17(21)4-6-18;3-2(4,5)1(6)7/h3-6,16H,7-15H2,1-2H3,(H,22,26);(H,6,7)
InChI Key:
YNMYIJSFFJXIRV-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.CN(CCSSCCNC(=O)C1CCN(CC1)C(=O)CSc1ccc(cc1)Cl)C
