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

Systemtic Name: N-[2-(azepan-1-yl)-2-(4-chlorophenyl)ethyl]-5-(4-bromophenyl)sulfonyl-furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(4-chlorophenyl)ethyl]-5-(4-bromophenyl)sulfonyl-furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(4-chlorophenyl)ethyl]-5-(4-bromophenyl)sulfonyl-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-(4-chlorophenyl)ethyl]-5-(4-bromophenyl)sulfonylfuran-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(4-chlorophenyl)ethyl]-5-brosyl-2-furamide Formula: C25H26BrClN2O4S MolecularWeight: 565.90694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26BrClN2O4S/c26-19-7-11-21(12-8-19)34(31,32)24-14-13-23(33-24)25(30)28-17-22(18-5-9-20(27)10-6-18)29-15-3-1-2-4-16-29/h5-14,22H,1-4,15-17H2,(H,28,30)