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

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[phenyl(thiophen-2-yl)methyl]propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[phenyl(2-thienyl)methyl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[phenyl(thiophen-2-yl)methyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[phenyl(thiophen-2-yl)methyl]propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[phenyl(2-thienyl)methyl]propionamide Formula: C22H21NO5S2 MolecularWeight: 443.53584

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)NC(C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)NC(C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H21NO5S2/c24-21(23-22(20-7-4-13-29-20)16-5-2-1-3-6-16)10-14-30(25,26)17-8-9-18-19(15-17)28-12-11-27-18/h1-9,13,15,22H,10-12,14H2,(H,23,24)