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

Systemtic Name: N-[2-(azepan-1-yl)-2-(4-propan-2-ylphenyl)ethyl]-5-(phenylsulfonyl)furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(4-isopropylphenyl)ethyl]-5-(benzenesulfonyl)furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(4-propan-2-ylphenyl)ethyl]-5-(benzenesulfonyl)-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(4-propan-2-ylphenyl)ethyl]-5-(benzenesulfonyl)furan-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-p-cumenyl-ethyl]-5-besyl-2-furamide Formula: C28H34N2O4S MolecularWeight: 494.64556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N2O4S/c1-21(2)22-12-14-23(15-13-22)25(30-18-8-3-4-9-19-30)20-29-28(31)26-16-17-27(34-26)35(32,33)24-10-6-5-7-11-24/h5-7,10-17,21,25H,3-4,8-9,18-20H2,1-2H3,(H,29,31)