N-[4-[(2-nitrophenyl)methylsulfonylamino]phenyl]-2-sulfanyl-benzamide

Systemtic Name: N-[4-[(2-nitrophenyl)methylsulfonylamino]phenyl]-2-sulfanyl-benzamide Openeye Name: N-[4-[(2-nitrophenyl)methylsulfonylamino]phenyl]-2-sulfanyl-benzamide CAS Name: 2-mercapto-N-[4-[(2-nitrophenyl)methylsulfonylamino]phenyl]benzamide IUPAC Name: N-[4-[(2-nitrophenyl)methylsulfonylamino]phenyl]-2-sulfanylbenzamide Traditional Name: 2-mercapto-N-[4-[(2-nitrobenzyl)sulfonylamino]phenyl]benzamide Formula: C20H17N3O5S2 MolecularWeight: 443.49608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CS(=O)(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3S)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CS(=O)(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3S)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5S2/c24-20(17-6-2-4-8-19(17)29)21-15-9-11-16(12-10-15)22-30(27,28)13-14-5-1-3-7-18(14)23(25)26/h1-12,22,29H,13H2,(H,21,24)