(2S)-2-(2-methylsulfonylethanoylamino)-8-oxidanylidene-N-[2-(2-phenyl-1H-indol-3-yl)ethyl]nonanamide

Systemtic Name: (2S)-2-(2-methylsulfonylethanoylamino)-8-oxidanylidene-N-[2-(2-phenyl-1H-indol-3-yl)ethyl]nonanamide Openeye Name: (2S)-2-[(2-methylsulfonylacetyl)amino]-8-oxo-N-[2-(2-phenyl-1H-indol-3-yl)ethyl]nonanamide CAS Name: (2S)-2-[(2-methylsulfonyl-1-oxoethyl)amino]-8-oxo-N-[2-(2-phenyl-1H-indol-3-yl)ethyl]nonanamide IUPAC Name: (2S)-2-[(2-methylsulfonylacetyl)amino]-8-oxo-N-[2-(2-phenyl-1H-indol-3-yl)ethyl]nonanamide Traditional Name: (2S)-8-keto-2-[(2-mesylacetyl)amino]-N-[2-(2-phenyl-1H-indol-3-yl)ethyl]pelargonamide Formula: C28H35N3O5S MolecularWeight: 525.6596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCC(C(=O)NCCC1=C(NC2=CC=CC=C21)C3=CC=CC=C3)NC(=O)CS(=O)(=O)C

Isomeric SMILES

CC(=O)CCCCC[C@@H](C(=O)NCCC1=C(NC2=CC=CC=C21)C3=CC=CC=C3)NC(=O)CS(=O)(=O)C

InChI

InChI=1S/C28H35N3O5S/c1-20(32)11-5-3-8-16-25(30-26(33)19-37(2,35)36)28(34)29-18-17-23-22-14-9-10-15-24(22)31-27(23)21-12-6-4-7-13-21/h4,6-7,9-10,12-15,25,31H,3,5,8,11,16-19H2,1-2H3,(H,29,34)(H,30,33)/t25-/m0/s1