4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(3-imidazol-1-ylpropyl)benzamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(3-imidazol-1-ylpropyl)benzamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(3-imidazol-1-ylpropyl)benzamide Formula: C21H22N4O5S MolecularWeight: 442.48818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C21H22N4O5S/c26-21(23-8-1-10-25-11-9-22-15-25)16-2-4-17(5-3-16)24-31(27,28)18-6-7-19-20(14-18)30-13-12-29-19/h2-7,9,11,14-15,24H,1,8,10,12-13H2,(H,23,26)