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LSM-2588

PropertiesImage
MNX_IDMNXM529286 Image of MNXM529286
referencechebi:92471
formulaC20H21ClFN3OS
global charge0
mol weight405.926
InChIKeyULGYLIIHFCGDFU-UHFFFAOYSA-N
InChIInChI=1S/C20H21ClFN3OS/c1-5-23-20-24(6-2)19(26)18(27-20)10-14-9-12(3)25(13(14)4)17-8-7-15(21)11-16(17)22/h7-11H,5-6H2,1-4H3
SMILESCCN=C1SC(=CC2=C(C)N(C3=C(F)C=C(Cl)C=C3)C(C)=C2)C(=O)N1CC
MNX internals
InChI (mnx)InChI=1/C20H21ClFN3OS/c1-5-23-20-24(6-2)19(26)18(27-20)10-14-9-12(3)25(13(14)4)17-8-7-15(21)11-16(17)22/h7-11H,5-6H2,1-4H3/b18-10?,23-20? Image of MNXM529286
SMILES (mnx)[CH3:1][CH2:5][N:23]=[C:20]1[N:24]([CH2:6][CH3:2])[C:19](=[O:26])[C:18](=[CH:10][C:14]2=[C:13]([CH3:4])[N:25]([C:17]3=[C:16]([F:22])[CH:11]=[C:15]([Cl:21])[CH:7]=[CH:8]3)[C:12]([CH3:3])=[CH:9]2)[S:27]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:92471
chebi:92471
ULGYLIIHFCGDFU-UHFFFAOYSA-N 		LSM-2588