N-[3-[[2-(4-nitrophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[[2-(4-nitrophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide Openeye Name: N-[3-[[2-(4-nitrophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide CAS Name: N-[3-[[[2-[(4-nitrophenyl)thio]-1-oxopropyl]amino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[[2-(4-nitrophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide Traditional Name: N-[3-[[2-[(4-nitrophenyl)thio]propanoylamino]methyl]phenyl]-2-furamide Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)NC(=O)C2=CC=CO2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC1=CC(=CC=C1)NC(=O)C2=CC=CO2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5S/c1-14(30-18-9-7-17(8-10-18)24(27)28)20(25)22-13-15-4-2-5-16(12-15)23-21(26)19-6-3-11-29-19/h2-12,14H,13H2,1H3,(H,22,25)(H,23,26)