N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]furan-2-carboxamide

Systemtic Name: N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]furan-2-carboxamide Openeye Name: N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]furan-2-carboxamide CAS Name: N-[3-(2-hydroxyethylthio)-5-nitrophenyl]-2-furancarboxamide IUPAC Name: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]furan-2-carboxamide Traditional Name: N-[3-(2-hydroxyethylthio)-5-nitro-phenyl]-2-furamide Formula: C13H12N2O5S MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC(=CC(=C2)SCCO)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC(=CC(=C2)SCCO)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O5S/c16-3-5-21-11-7-9(6-10(8-11)15(18)19)14-13(17)12-2-1-4-20-12/h1-2,4,6-8,16H,3,5H2,(H,14,17)