(2R)-2-acetamido-N-[(2S)-2-ethylhexyl]-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: (2R)-2-acetamido-N-[(2S)-2-ethylhexyl]-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: (2R)-2-acetamido-N-[(2S)-2-ethylhexyl]-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: (2R)-2-acetamido-N-[(2S)-2-ethylhexyl]-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: (2R)-2-acetamido-N-[(2S)-2-ethylhexyl]-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: (2R)-2-acetamido-N-[(2S)-2-ethylhexyl]-3-[(4-methoxyphenyl)thio]propionamide Formula: C20H32N2O3S MolecularWeight: 380.54468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C(CSC1=CC=C(C=C1)OC)NC(=O)C

Isomeric SMILES

CCCC[C@H](CC)CNC(=O)[C@H](CSC1=CC=C(C=C1)OC)NC(=O)C

InChI

InChI=1S/C20H32N2O3S/c1-5-7-8-16(6-2)13-21-20(24)19(22-15(3)23)14-26-18-11-9-17(25-4)10-12-18/h9-12,16,19H,5-8,13-14H2,1-4H3,(H,21,24)(H,22,23)/t16-,19-/m0/s1