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2-(6,6-dimethylhept-4-ynylamino)-2-naphthalen-2-ylsulfanyl-N-pentyl-butanamide
2-(6,6-dimethylhept-4-ynylamino)-2-naphthalen-2-ylsulfanyl-N-pentyl-butanamide
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCNC(=O)C(CC)(NCCCC#CC(C)(C)C)SC1=CC2=CC=CC=C2C=C1
Isomeric SMILES
CCCCCNC(=O)C(CC)(NCCCC#CC(C)(C)C)SC1=CC2=CC=CC=C2C=C1
InChI
InChI=1S/C28H40N2OS/c1-6-8-13-20-29-26(31)28(7-2,30-21-14-9-12-19-27(3,4)5)32-25-18-17-23-15-10-11-16-24(23)22-25/h10-11,15-18,22,30H,6-9,13-14,20-21H2,1-5H3,(H,29,31)
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- 2-(6,6-dimethylhepta-2,4-diynylamino)-2-naphthalen-2-ylsulfanyl-N-pentyl-butanamide
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