2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(3-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(3-methylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-[2-(1-pyrrolidinyl)ethyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(3-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidin-1-ylethyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-(2-pyrrolidinoethyl)amino]-N-homoveratryl-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C32H42N4O6S2 MolecularWeight: 642.82908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(CCN3CCCC3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=C(SC=C1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(CCN3CCCC3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C32H42N4O6S2/c1-24-14-20-43-31(24)22-35(17-13-26-7-12-29(41-3)30(21-26)42-4)32(38)23-36(19-18-34-15-5-6-16-34)44(39,40)28-10-8-27(9-11-28)33-25(2)37/h7-12,14,20-21H,5-6,13,15-19,22-23H2,1-4H3,(H,33,37)