2-[2-[(5-nitrofuran-2-yl)methylamino]phenyl]sulfanylethanamide

Systemtic Name: 2-[2-[(5-nitrofuran-2-yl)methylamino]phenyl]sulfanylethanamide Openeye Name: 2-[2-[(5-nitro-2-furyl)methylamino]phenyl]sulfanylacetamide CAS Name: 2-[[2-[(5-nitro-2-furanyl)methylamino]phenyl]thio]acetamide IUPAC Name: 2-[2-[(5-nitrofuran-2-yl)methylamino]phenyl]sulfanylacetamide Traditional Name: 2-[[2-[(5-nitro-2-furyl)methylamino]phenyl]thio]acetamide Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCC2=CC=C(O2)[N+](=O)[O-])SCC(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)NCC2=CC=C(O2)[N+](=O)[O-])SCC(=O)N

InChI

InChI=1S/C13H13N3O4S/c14-12(17)8-21-11-4-2-1-3-10(11)15-7-9-5-6-13(20-9)16(18)19/h1-6,15H,7-8H2,(H2,14,17)