5-(azepan-1-ylsulfonyl)-N-ethyl-3-methyl-N-(phenylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-ethyl-3-methyl-N-(phenylmethyl)-1-benzofuran-2-carboxamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-benzyl-N-ethyl-3-methyl-benzofuran-2-carboxamide CAS Name: 5-(1-azepanylsulfonyl)-N-ethyl-3-methyl-N-(phenylmethyl)-2-benzofurancarboxamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-benzyl-N-ethyl-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-benzyl-N-ethyl-3-methyl-coumarilamide Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C

InChI

InChI=1S/C25H30N2O4S/c1-3-26(18-20-11-7-6-8-12-20)25(28)24-19(2)22-17-21(13-14-23(22)31-24)32(29,30)27-15-9-4-5-10-16-27/h6-8,11-14,17H,3-5,9-10,15-16,18H2,1-2H3