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

Systemtic Name: N-[2-(azepan-1-yl)-2-(4-propan-2-ylphenyl)ethyl]-5-(4-bromophenyl)sulfonyl-furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(4-isopropylphenyl)ethyl]-5-(4-bromophenyl)sulfonyl-furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(4-propan-2-ylphenyl)ethyl]-5-(4-bromophenyl)sulfonyl-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(4-propan-2-ylphenyl)ethyl]-5-(4-bromophenyl)sulfonylfuran-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-p-cumenyl-ethyl]-5-brosyl-2-furamide Formula: C28H33BrN2O4S MolecularWeight: 573.54162

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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=C(C=C3)Br)N4CCCCCC4

Isomeric SMILES

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

InChI

InChI=1S/C28H33BrN2O4S/c1-20(2)21-7-9-22(10-8-21)25(31-17-5-3-4-6-18-31)19-30-28(32)26-15-16-27(35-26)36(33,34)24-13-11-23(29)12-14-24/h7-16,20,25H,3-6,17-19H2,1-2H3,(H,30,32)