1-methyl-4-[4-[4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[4-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[oxo-[4-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[4-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 4-[4-[4-[(2-ketopyrrolidino)methyl]benzoyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C22H27N5O5S MolecularWeight: 473.54528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCC4=O

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCC4=O

InChI

InChI=1S/C22H27N5O5S/c1-24-15-18(13-19(24)21(23)29)33(31,32)27-11-9-25(10-12-27)22(30)17-6-4-16(5-7-17)14-26-8-2-3-20(26)28/h4-7,13,15H,2-3,8-12,14H2,1H3,(H2,23,29)