N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(2-thienylsulfonylamino)phenyl]sulfanyl-propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(thiophen-2-ylsulfonylamino)phenyl]thio]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanylpropanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(2-thienylsulfonylamino)phenyl]thio]propionamide Formula: C21H20N2O5S3 MolecularWeight: 476.5889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)SC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)SC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H20N2O5S3/c1-14(21(24)22-16-6-9-18-19(13-16)28-11-10-27-18)30-17-7-4-15(5-8-17)23-31(25,26)20-3-2-12-29-20/h2-9,12-14,23H,10-11H2,1H3,(H,22,24)