5-chloranyl-2-nitro-N-[4-(3-oxidanylidenethiomorpholin-4-yl)sulfonylphenyl]benzamide

Systemtic Name: 5-chloranyl-2-nitro-N-[4-(3-oxidanylidenethiomorpholin-4-yl)sulfonylphenyl]benzamide Openeye Name: 5-chloro-2-nitro-N-[4-(3-oxothiomorpholin-4-yl)sulfonylphenyl]benzamide CAS Name: 5-chloro-2-nitro-N-[4-[(3-oxo-4-thiomorpholinyl)sulfonyl]phenyl]benzamide IUPAC Name: 5-chloro-2-nitro-N-[4-(3-oxothiomorpholin-4-yl)sulfonylphenyl]benzamide Traditional Name: 5-chloro-N-[4-(3-ketothiomorpholin-4-yl)sulfonylphenyl]-2-nitro-benzamide Formula: C17H14ClN3O6S2 MolecularWeight: 455.89256

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(=O)N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CSCC(=O)N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O6S2/c18-11-1-6-15(21(24)25)14(9-11)17(23)19-12-2-4-13(5-3-12)29(26,27)20-7-8-28-10-16(20)22/h1-6,9H,7-8,10H2,(H,19,23)