N-(1,3-benzodioxol-5-yl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-propanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,3-benzodioxol-5-yl)propanamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(1,3-benzodioxol-5-yl)propanamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,3-benzodioxol-5-yl)propanamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(1,3-benzodioxol-5-yl)propionamide Formula: C22H20N2O5S2 MolecularWeight: 456.5346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O5S2/c1-15(22(25)23-17-9-12-20-21(13-17)29-14-28-20)30-18-10-7-16(8-11-18)24-31(26,27)19-5-3-2-4-6-19/h2-13,15,24H,14H2,1H3,(H,23,25)