5-chloranyl-2-[(4-chlorophenyl)sulfonylamino]-N-(2-nitro-5-propyl-3-sulfanyl-phenyl)benzamide

Systemtic Name: 5-chloranyl-2-[(4-chlorophenyl)sulfonylamino]-N-(2-nitro-5-propyl-3-sulfanyl-phenyl)benzamide Openeye Name: 5-chloro-2-[(4-chlorophenyl)sulfonylamino]-N-(2-nitro-5-propyl-3-sulfanyl-phenyl)benzamide CAS Name: 5-chloro-2-[(4-chlorophenyl)sulfonylamino]-N-(3-mercapto-2-nitro-5-propylphenyl)benzamide IUPAC Name: 5-chloro-2-[(4-chlorophenyl)sulfonylamino]-N-(2-nitro-5-propyl-3-sulfanylphenyl)benzamide Traditional Name: 5-chloro-2-[(4-chlorophenyl)sulfonylamino]-N-(3-mercapto-2-nitro-5-propyl-phenyl)benzamide Formula: C22H19Cl2N3O5S2 MolecularWeight: 540.43936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)S)[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC1=CC(=C(C(=C1)S)[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H19Cl2N3O5S2/c1-2-3-13-10-19(21(27(29)30)20(33)11-13)25-22(28)17-12-15(24)6-9-18(17)26-34(31,32)16-7-4-14(23)5-8-16/h4-12,26,33H,2-3H2,1H3,(H,25,28)