N-[3-[(4-nitrophenyl)amino]propylcarbamothioyl]furan-2-carboxamide

Systemtic Name: N-[3-[(4-nitrophenyl)amino]propylcarbamothioyl]furan-2-carboxamide Openeye Name: N-[3-(4-nitroanilino)propylcarbamothioyl]furan-2-carboxamide CAS Name: N-[[3-(4-nitroanilino)propylamino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[3-(4-nitroanilino)propylcarbamothioyl]furan-2-carboxamide Traditional Name: N-[3-(4-nitroanilino)propylthiocarbamoyl]-2-furamide Formula: C15H16N4O4S MolecularWeight: 348.37694

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(=S)NCCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(=O)NC(=S)NCCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O4S/c20-14(13-3-1-10-23-13)18-15(24)17-9-2-8-16-11-4-6-12(7-5-11)19(21)22/h1,3-7,10,16H,2,8-9H2,(H2,17,18,20,24)