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2-(6,6-dimethylhepta-2,4-diynylamino)-N-hexyl-2-naphthalen-1-ylsulfanyl-butanamide

2-(6,6-dimethylhepta-2,4-diynylamino)-N-hexyl-2-naphthalen-1-ylsulfanyl-butanamide

Systemtic Name:2-(6,6-dimethylhepta-2,4-diynylamino)-N-hexyl-2-naphthalen-1-ylsulfanyl-butanamide
Openeye Name:2-(6,6-dimethylhepta-2,4-diynylamino)-N-hexyl-2-(1-naphthylsulfanyl)butanamide
CAS Name:2-(6,6-dimethylhepta-2,4-diynylamino)-N-hexyl-2-(1-naphthalenylthio)butanamide
IUPAC Name:2-(6,6-dimethylhepta-2,4-diynylamino)-N-hexyl-2-naphthalen-1-ylsulfanylbutanamide
Traditional Name:2-(6,6-dimethylhepta-2,4-diynylamino)-N-hexyl-2-(1-naphthylthio)butyramide
Formula: C29H38N2OS
MolecularWeight: 462.68982
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C(CC)(NCC#CC#CC(C)(C)C)SC1=CC=CC2=CC=CC=C21


Isomeric SMILES

CCCCCCNC(=O)C(CC)(NCC#CC#CC(C)(C)C)SC1=CC=CC2=CC=CC=C21


InChI

InChI=1S/C29H38N2OS/c1-6-8-9-14-22-30-27(32)29(7-2,31-23-15-10-13-21-28(3,4)5)33-26-20-16-18-24-17-11-12-19-25(24)26/h11-12,16-20,31H,6-9,14,22-23H2,1-5H3,(H,30,32)


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