N'-cycloheptyl-N-[(2R)-2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]ethanediamide

Systemtic Name: N'-cycloheptyl-N-[(2R)-2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]ethanediamide Openeye Name: N'-cycloheptyl-N-[(2R)-2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]oxamide CAS Name: N'-cycloheptyl-N-[(2R)-2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]oxamide IUPAC Name: N'-cycloheptyl-N-[(2R)-2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]oxamide Traditional Name: N'-cycloheptyl-N-[(2R)-2-(2-thienyl)-2-tosyl-ethyl]oxamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NC2CCCCCC2)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@H](CNC(=O)C(=O)NC2CCCCCC2)C3=CC=CS3

InChI

InChI=1S/C22H28N2O4S2/c1-16-10-12-18(13-11-16)30(27,28)20(19-9-6-14-29-19)15-23-21(25)22(26)24-17-7-4-2-3-5-8-17/h6,9-14,17,20H,2-5,7-8,15H2,1H3,(H,23,25)(H,24,26)/t20-/m1/s1