1-butyl-5-oxidanylidene-N-[4-[(2-oxidanylidenethiolan-3-yl)carbamoyl]phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-butyl-5-oxidanylidene-N-[4-[(2-oxidanylidenethiolan-3-yl)carbamoyl]phenyl]pyrrolidine-3-carboxamide Openeye Name: 1-butyl-5-oxo-N-[4-[(2-oxotetrahydrothiophen-3-yl)carbamoyl]phenyl]pyrrolidine-3-carboxamide CAS Name: 1-butyl-5-oxo-N-[4-[oxo-[(2-oxo-3-thiolanyl)amino]methyl]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-butyl-5-oxo-N-[4-[(2-oxothiolan-3-yl)carbamoyl]phenyl]pyrrolidine-3-carboxamide Traditional Name: 1-butyl-5-keto-N-[4-[(2-ketotetrahydrothiophen-3-yl)carbamoyl]phenyl]pyrrolidine-3-carboxamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3CCSC3=O

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3CCSC3=O

InChI

InChI=1S/C20H25N3O4S/c1-2-3-9-23-12-14(11-17(23)24)19(26)21-15-6-4-13(5-7-15)18(25)22-16-8-10-28-20(16)27/h4-7,14,16H,2-3,8-12H2,1H3,(H,21,26)(H,22,25)