1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)pyrrolidine-3-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]pyrrolidine-3-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)pyrrolidine-3-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-N-[2-pyrrolidino-2-(2-thienyl)ethyl]pyrrolidine-3-carboxamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4)C5=CC=CS5

InChI

InChI=1S/C23H27N3O4S/c27-22-12-16(15-26(22)17-5-6-19-20(13-17)30-10-9-29-19)23(28)24-14-18(21-4-3-11-31-21)25-7-1-2-8-25/h3-6,11,13,16,18H,1-2,7-10,12,14-15H2,(H,24,28)