N-[2-(azepan-1-yl)-2-(4-ethoxyphenyl)ethyl]-5-(4-methylphenyl)sulfonyl-furan-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-(4-ethoxyphenyl)ethyl]-5-(4-methylphenyl)sulfonyl-furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(4-ethoxyphenyl)ethyl]-5-(p-tolylsulfonyl)furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(4-ethoxyphenyl)ethyl]-5-(4-methylphenyl)sulfonyl-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(4-ethoxyphenyl)ethyl]-5-(4-methylphenyl)sulfonylfuran-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-p-phenetyl-ethyl]-5-tosyl-2-furamide Formula: C28H34N2O5S MolecularWeight: 510.64496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=C(C=C3)C)N4CCCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=C(C=C3)C)N4CCCCCC4

InChI

InChI=1S/C28H34N2O5S/c1-3-34-23-12-10-22(11-13-23)25(30-18-6-4-5-7-19-30)20-29-28(31)26-16-17-27(35-26)36(32,33)24-14-8-21(2)9-15-24/h8-17,25H,3-7,18-20H2,1-2H3,(H,29,31)