N-(4-methylsulfanylphenyl)-5-oxidanylidene-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide

Systemtic Name: N-(4-methylsulfanylphenyl)-5-oxidanylidene-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Openeye Name: N-(4-methylsulfanylphenyl)-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide CAS Name: N-[4-(methylthio)phenyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: N-(4-methylsulfanylphenyl)-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: 5-keto-N-[4-(methylthio)phenyl]-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Formula: C21H24N2O5S MolecularWeight: 416.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H24N2O5S/c1-26-17-10-15(11-18(27-2)20(17)28-3)23-12-13(9-19(23)24)21(25)22-14-5-7-16(29-4)8-6-14/h5-8,10-11,13H,9,12H2,1-4H3,(H,22,25)