(2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-phenyl-propanamide

Systemtic Name: (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-phenyl-propanamide Openeye Name: (2S)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanamide CAS Name: (2S)-N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-2-(1,3-dioxo-2-isoindolyl)-3-phenylpropanamide IUPAC Name: (2S)-N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide Traditional Name: (2S)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-3-phenyl-2-phthalimido-propionamide Formula: C27H24ClN3O6S MolecularWeight: 554.01396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)[C@H](CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H24ClN3O6S/c28-22-11-10-19(38(35,36)30-12-14-37-15-13-30)17-23(22)29-25(32)24(16-18-6-2-1-3-7-18)31-26(33)20-8-4-5-9-21(20)27(31)34/h1-11,17,24H,12-16H2,(H,29,32)/t24-/m0/s1