N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C19H17ClN2O6S3 MolecularWeight: 500.99608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=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/C19H17ClN2O6S3/c1-13-4-7-15(22(23)24)11-18(13)31(27,28)21-12-19(17-3-2-10-29-17)30(25,26)16-8-5-14(20)6-9-16/h2-11,19,21H,12H2,1H3