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N-(cyanomethyl)-4-methyl-2-[[4-[4-(trifluoromethyl)phenyl]thiophen-3-yl]amino]pentanamide
N-(cyanomethyl)-4-methyl-2-[[4-[4-(trifluoromethyl)phenyl]thiophen-3-yl]amino]pentanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)CC(C(=O)NCC#N)NC1=CSC=C1C2=CC=C(C=C2)C(F)(F)F
Isomeric SMILES
CC(C)CC(C(=O)NCC#N)NC1=CSC=C1C2=CC=C(C=C2)C(F)(F)F
InChI
InChI=1S/C19H20F3N3OS/c1-12(2)9-16(18(26)24-8-7-23)25-17-11-27-10-15(17)13-3-5-14(6-4-13)19(20,21)22/h3-6,10-12,16,25H,8-9H2,1-2H3,(H,24,26)
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