2-chloranyl-N-[2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-thiophen-2-yl-ethyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-thiophen-2-yl-ethyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(2-thienyl)ethyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[2-(4-fluoro-3-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-(4-fluoro-3-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(2-thienyl)ethyl]-4-nitro-benzamide Formula: C20H16ClFN2O5S2 MolecularWeight: 482.932843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CS3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CS3)F

InChI

InChI=1S/C20H16ClFN2O5S2/c1-12-9-14(5-7-17(12)22)31(28,29)19(18-3-2-8-30-18)11-23-20(25)15-6-4-13(24(26)27)10-16(15)21/h2-10,19H,11H2,1H3,(H,23,25)