N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-2-nitro-benzenesulfonamide Openeye Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-2-nitrobenzenesulfonamide Traditional Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-2-nitro-benzenesulfonamide Formula: C18H15ClN2O6S3 MolecularWeight: 486.9695

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN2O6S3/c19-13-7-9-14(10-8-13)29(24,25)18(16-5-3-11-28-16)12-20-30(26,27)17-6-2-1-4-15(17)21(22)23/h1-11,18,20H,12H2