N-[2-(azepan-1-yl)-2-(4-propoxyphenyl)ethyl]-5-(phenylsulfonyl)furan-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-(4-propoxyphenyl)ethyl]-5-(phenylsulfonyl)furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(4-propoxyphenyl)ethyl]-5-(benzenesulfonyl)furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(4-propoxyphenyl)ethyl]-5-(benzenesulfonyl)-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(4-propoxyphenyl)ethyl]-5-(benzenesulfonyl)furan-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(4-propoxyphenyl)ethyl]-5-besyl-2-furamide Formula: C28H34N2O5S MolecularWeight: 510.64496

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=CC=C3)N4CCCCCC4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=CC=C3)N4CCCCCC4

InChI

InChI=1S/C28H34N2O5S/c1-2-20-34-23-14-12-22(13-15-23)25(30-18-8-3-4-9-19-30)21-29-28(31)26-16-17-27(35-26)36(32,33)24-10-6-5-7-11-24/h5-7,10-17,25H,2-4,8-9,18-21H2,1H3,(H,29,31)