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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N,N-dibutyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N,N-dibutyl-3-methyl-benzofuran-2-carboxamide CAS Name: 5-(1-azepanylsulfonyl)-N,N-dibutyl-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N,N-dibutyl-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N,N-dibutyl-3-methyl-coumarilamide Formula: C24H36N2O4S MolecularWeight: 448.61864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C1=C(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CCCCN(CCCC)C(=O)C1=C(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C24H36N2O4S/c1-4-6-14-25(15-7-5-2)24(27)23-19(3)21-18-20(12-13-22(21)30-23)31(28,29)26-16-10-8-9-11-17-26/h12-13,18H,4-11,14-17H2,1-3H3