2-[2-(3,5-ditert-butylphenyl)sulfanylcyclohexyl]sulfanyl-N-[1-(1-methylpyrrolidin-2-yl)ethyl]ethanamide

Systemtic Name: 2-[2-(3,5-ditert-butylphenyl)sulfanylcyclohexyl]sulfanyl-N-[1-(1-methylpyrrolidin-2-yl)ethyl]ethanamide Openeye Name: 2-[2-(3,5-ditert-butylphenyl)sulfanylcyclohexyl]sulfanyl-N-[1-(1-methylpyrrolidin-2-yl)ethyl]acetamide CAS Name: 2-[[2-[(3,5-ditert-butylphenyl)thio]cyclohexyl]thio]-N-[1-(1-methyl-2-pyrrolidinyl)ethyl]acetamide IUPAC Name: 2-[2-(3,5-ditert-butylphenyl)sulfanylcyclohexyl]sulfanyl-N-[1-(1-methylpyrrolidin-2-yl)ethyl]acetamide Traditional Name: 2-[[2-[(3,5-ditert-butylphenyl)thio]cyclohexyl]thio]-N-[1-(1-methylpyrrolidin-2-yl)ethyl]acetamide Formula: C29H48N2OS2 MolecularWeight: 504.83422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN1C)NC(=O)CSC2CCCCC2SC3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C1CCCN1C)NC(=O)CSC2CCCCC2SC3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C29H48N2OS2/c1-20(24-12-11-15-31(24)8)30-27(32)19-33-25-13-9-10-14-26(25)34-23-17-21(28(2,3)4)16-22(18-23)29(5,6)7/h16-18,20,24-26H,9-15,19H2,1-8H3,(H,30,32)