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

Systemtic Name: N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-5-(phenylsulfonyl)furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-5-(benzenesulfonyl)furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(4-methoxyphenyl)ethyl]-5-(benzenesulfonyl)-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-5-(benzenesulfonyl)furan-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-5-besyl-2-furamide Formula: C26H30N2O5S MolecularWeight: 482.5918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=CC=C3)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=CC=C3)N4CCCCCC4

InChI

InChI=1S/C26H30N2O5S/c1-32-21-13-11-20(12-14-21)23(28-17-7-2-3-8-18-28)19-27-26(29)24-15-16-25(33-24)34(30,31)22-9-5-4-6-10-22/h4-6,9-16,23H,2-3,7-8,17-19H2,1H3,(H,27,29)