2-(2,4-ditert-butylphenyl)sulfanyl-2-(6,6-dimethylhepta-2,4-diynylamino)-N-pentyl-butanamide

Systemtic Name: 2-(2,4-ditert-butylphenyl)sulfanyl-2-(6,6-dimethylhepta-2,4-diynylamino)-N-pentyl-butanamide Openeye Name: 2-(2,4-ditert-butylphenyl)sulfanyl-2-(6,6-dimethylhepta-2,4-diynylamino)-N-pentyl-butanamide CAS Name: 2-[(2,4-ditert-butylphenyl)thio]-2-(6,6-dimethylhepta-2,4-diynylamino)-N-pentylbutanamide IUPAC Name: 2-(2,4-ditert-butylphenyl)sulfanyl-2-(6,6-dimethylhepta-2,4-diynylamino)-N-pentylbutanamide Traditional Name: N-amyl-2-[(2,4-ditert-butylphenyl)thio]-2-(6,6-dimethylhepta-2,4-diynylamino)butyramide Formula: C32H50N2OS MolecularWeight: 510.8172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(CC)(NCC#CC#CC(C)(C)C)SC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCNC(=O)C(CC)(NCC#CC#CC(C)(C)C)SC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C32H50N2OS/c1-12-14-17-22-33-28(35)32(13-2,34-23-18-15-16-21-29(3,4)5)36-27-20-19-25(30(6,7)8)24-26(27)31(9,10)11/h19-20,24,34H,12-14,17,22-23H2,1-11H3,(H,33,35)