2-quinolin-2-ylsulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide

Systemtic Name: 2-quinolin-2-ylsulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide Openeye Name: 2-(2-quinolylsulfanyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide CAS Name: 2-(2-quinolinylthio)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)acetamide IUPAC Name: 2-quinolin-2-ylsulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylacetamide Traditional Name: 2-(2-quinolylthio)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CSC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CSC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H20N2O3S/c25-20(14-28-21-10-7-15-5-1-2-6-17(15)24-21)23-16-8-9-18-19(13-16)27-22(26-18)11-3-4-12-22/h1-2,5-10,13H,3-4,11-12,14H2,(H,23,25)