(3S)-N-[2-(butylcarbamoyl)phenyl]-1-cyclohexyl-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[2-(butylcarbamoyl)phenyl]-1-cyclohexyl-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-[2-(butylcarbamoyl)phenyl]-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[2-[butylamino(oxo)methyl]phenyl]-1-cyclohexyl-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-[2-(butylcarbamoyl)phenyl]-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-[2-(butylcarbamoyl)phenyl]-1-cyclohexyl-5-keto-pyrrolidine-3-carboxamide Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)C2CC(=O)N(C2)C3CCCCC3

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)[C@H]2CC(=O)N(C2)C3CCCCC3

InChI

InChI=1S/C22H31N3O3/c1-2-3-13-23-22(28)18-11-7-8-12-19(18)24-21(27)16-14-20(26)25(15-16)17-9-5-4-6-10-17/h7-8,11-12,16-17H,2-6,9-10,13-15H2,1H3,(H,23,28)(H,24,27)/t16-/m0/s1