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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-phthalimido-propionamide Formula: C21H20ClN3O5S MolecularWeight: 461.9186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCC2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCC2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H20ClN3O5S/c1-13(25-20(27)15-6-2-3-7-16(15)21(25)28)19(26)23-14-8-9-17(22)18(12-14)31(29,30)24-10-4-5-11-24/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,26)