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

Systemtic Name: 4,4-bis(oxidanylidene)-5-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: 4,4-dioxo-5-phenyl-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: 4,4-dioxo-5-phenyl-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: 4,4-dioxo-5-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: 4,4-diketo-5-phenyl-N-[2-pyrrolidino-2-(2-thienyl)ethyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C21H24N2O4S2/c24-21(22-15-17(18-9-6-13-28-18)23-10-4-5-11-23)19-20(16-7-2-1-3-8-16)29(25,26)14-12-27-19/h1-3,6-9,13,17H,4-5,10-12,14-15H2,(H,22,24)