5-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-benzofuran-2-carboxamide CAS Name: 5-(1-azepanylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-piperonyl-coumarilamide Formula: C24H26N2O6S MolecularWeight: 470.53804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H26N2O6S/c1-16-19-13-18(33(28,29)26-10-4-2-3-5-11-26)7-9-20(19)32-23(16)24(27)25-14-17-6-8-21-22(12-17)31-15-30-21/h6-9,12-13H,2-5,10-11,14-15H2,1H3,(H,25,27)