N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-4-methylsulfinyl-benzamide

Systemtic Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-4-methylsulfinyl-benzamide Openeye Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-4-methylsulfinyl-benzamide CAS Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-4-methylsulfinylbenzamide IUPAC Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-4-methylsulfinylbenzamide Traditional Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-4-methylsulfinyl-benzamide Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC=C(C=C1)C(=O)NCC2(CCCC2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CS(=O)C1=CC=C(C=C1)C(=O)NCC2(CCCC2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25NO4S/c1-28(25)18-7-4-16(5-8-18)21(24)23-15-22(10-2-3-11-22)17-6-9-19-20(14-17)27-13-12-26-19/h4-9,14H,2-3,10-13,15H2,1H3,(H,23,24)