2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]acetamide Formula: C23H20N4O5S MolecularWeight: 464.4937

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H20N4O5S/c1-2-31-17-7-9-18(10-8-17)32-19-12-15(11-16(13-19)27(29)30)24-22(28)14-33-23-25-20-5-3-4-6-21(20)26-23/h3-13H,2,14H2,1H3,(H,24,28)(H,25,26)