(3R)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-N-(3-phenoxypropyl)pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-N-(3-phenoxypropyl)pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(4-methylsulfanylphenyl)-5-oxo-N-(3-phenoxypropyl)pyrrolidine-3-carboxamide CAS Name: (3R)-1-[4-(methylthio)phenyl]-5-oxo-N-(3-phenoxypropyl)-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(4-methylsulfanylphenyl)-5-oxo-N-(3-phenoxypropyl)pyrrolidine-3-carboxamide Traditional Name: (3R)-5-keto-1-[4-(methylthio)phenyl]-N-(3-phenoxypropyl)pyrrolidine-3-carboxamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCCOC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)NCCCOC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S/c1-27-19-10-8-17(9-11-19)23-15-16(14-20(23)24)21(25)22-12-5-13-26-18-6-3-2-4-7-18/h2-4,6-11,16H,5,12-15H2,1H3,(H,22,25)/t16-/m1/s1