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N-(cyanomethyl)-4-methyl-2-[4-(3-methylphenyl)phenyl]sulfanyl-pentanamide
N-(cyanomethyl)-4-methyl-2-[4-(3-methylphenyl)phenyl]sulfanyl-pentanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC=CC(=C1)C2=CC=C(C=C2)SC(CC(C)C)C(=O)NCC#N
Isomeric SMILES
CC1=CC=CC(=C1)C2=CC=C(C=C2)SC(CC(C)C)C(=O)NCC#N
InChI
InChI=1S/C21H24N2OS/c1-15(2)13-20(21(24)23-12-11-22)25-19-9-7-17(8-10-19)18-6-4-5-16(3)14-18/h4-10,14-15,20H,12-13H2,1-3H3,(H,23,24)
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