N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4,4-bis(oxidanylidene)-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4,4-bis(oxidanylidene)-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4,4-dioxo-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4,4-dioxo-5-phenyl-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4,4-dioxo-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: 4,4-diketo-N-[2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]-5-phenyl-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C24H28N2O5S MolecularWeight: 456.55452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C24H28N2O5S/c1-30-20-11-9-18(10-12-20)21(26-13-5-6-14-26)17-25-24(27)22-23(19-7-3-2-4-8-19)32(28,29)16-15-31-22/h2-4,7-12,21H,5-6,13-17H2,1H3,(H,25,27)