3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-phenylsulfanylpropyl)propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-phenylsulfanylpropyl)propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-phenylsulfanylpropyl)propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[3-(phenylthio)propyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-phenylsulfanylpropyl)propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[3-(phenylthio)propyl]propionamide Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C20H23NO5S2/c22-20(21-10-4-13-27-16-5-2-1-3-6-16)9-14-28(23,24)17-7-8-18-19(15-17)26-12-11-25-18/h1-3,5-8,15H,4,9-14H2,(H,21,22)