2-[butyl(2-phenylsulfanylethanoyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[butyl(2-phenylsulfanylethanoyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[butyl-(2-phenylsulfanylacetyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[butyl-[1-oxo-2-(phenylthio)ethyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: 2-[butyl-(2-phenylsulfanylacetyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[butyl-[2-(phenylthio)acetyl]amino]-N-homoveratryl-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C30H38N2O4S2 MolecularWeight: 554.76372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=C(S2)C)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCCCN(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=C(S2)C)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C30H38N2O4S2/c1-5-6-17-31(30(34)22-37-25-10-8-7-9-11-25)21-29(33)32(20-26-14-12-23(2)38-26)18-16-24-13-15-27(35-3)28(19-24)36-4/h7-15,19H,5-6,16-18,20-22H2,1-4H3