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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CSC(=C1)[C@H](CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN2O6S3/c19-13-3-7-15(8-4-13)29(24,25)18(17-2-1-11-28-17)12-20-30(26,27)16-9-5-14(6-10-16)21(22)23/h1-11,18,20H,12H2/t18-/m0/s1