2-[(4-cyanophenyl)methylsulfonyl]-N-[4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-[4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-[4-methoxy-3-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-(4-cyanobenzyl)sulfonyl-N-[3-(2-ketopyrrolidino)-4-methoxy-phenyl]acetamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CS(=O)(=O)CC2=CC=C(C=C2)C#N)N3CCCC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CS(=O)(=O)CC2=CC=C(C=C2)C#N)N3CCCC3=O

InChI

InChI=1S/C21H21N3O5S/c1-29-19-9-8-17(11-18(19)24-10-2-3-21(24)26)23-20(25)14-30(27,28)13-16-6-4-15(12-22)5-7-16/h4-9,11H,2-3,10,13-14H2,1H3,(H,23,25)