N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[octylsulfonyl(prop-2-enyl)amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[octylsulfonyl(prop-2-enyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[allyl(octylsulfonyl)amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-thienylmethyl)acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[octylsulfonyl(prop-2-enyl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[octylsulfonyl(prop-2-enyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[allyl(octylsulfonyl)amino]-N-homoveratryl-N-(2-thenyl)acetamide Formula: C28H42N2O5S2 MolecularWeight: 550.77348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N(CC=C)CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2

Isomeric SMILES

CCCCCCCCS(=O)(=O)N(CC=C)CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2

InChI

InChI=1S/C28H42N2O5S2/c1-5-7-8-9-10-11-20-37(32,33)30(17-6-2)23-28(31)29(22-25-13-12-19-36-25)18-16-24-14-15-26(34-3)27(21-24)35-4/h6,12-15,19,21H,2,5,7-11,16-18,20,22-23H2,1,3-4H3