2-[1-(3-nitrophenyl)sulfonylbenzimidazol-2-yl]sulfanyl-N-(4-phenoxyphenyl)ethanamide

Systemtic Name: 2-[1-(3-nitrophenyl)sulfonylbenzimidazol-2-yl]sulfanyl-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-[1-(3-nitrophenyl)sulfonylbenzimidazol-2-yl]sulfanyl-N-(4-phenoxyphenyl)acetamide CAS Name: 2-[[1-(3-nitrophenyl)sulfonyl-2-benzimidazolyl]thio]-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-[1-(3-nitrophenyl)sulfonylbenzimidazol-2-yl]sulfanyl-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-[[1-(3-nitrophenyl)sulfonylbenzimidazol-2-yl]thio]-N-(4-phenoxyphenyl)acetamide Formula: C27H20N4O6S2 MolecularWeight: 560.6009

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H20N4O6S2/c32-26(28-19-13-15-22(16-14-19)37-21-8-2-1-3-9-21)18-38-27-29-24-11-4-5-12-25(24)30(27)39(35,36)23-10-6-7-20(17-23)31(33)34/h1-17H,18H2,(H,28,32)