N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-3-nitro-benzenesulfonamide Formula: C18H15ClN2O6S3 MolecularWeight: 486.9695

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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