N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2-(3-oxidanylidenepiperazin-1-yl)ethanamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2-(3-oxidanylidenepiperazin-1-yl)ethanamide Openeye Name: N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-2-(3-oxopiperazin-1-yl)acetamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2-(3-oxo-1-piperazinyl)acetamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-2-(3-oxopiperazin-1-yl)acetamide Traditional Name: 2-(3-ketopiperazino)-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)acetamide Formula: C20H29N5O5S MolecularWeight: 451.53976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CN4CCNC(=O)C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CN4CCNC(=O)C4

InChI

InChI=1S/C20H29N5O5S/c26-19-14-23(8-5-21-19)15-20(27)22-17-13-16(3-4-18(17)24-6-1-2-7-24)31(28,29)25-9-11-30-12-10-25/h3-4,13H,1-2,5-12,14-15H2,(H,21,26)(H,22,27)