(4E)-4-(carbamothioylhydrazinylidene)-6-(furan-2-yl)-N-(2-nitrophenyl)-6-oxidanylidene-hexanamide

Systemtic Name: (4E)-4-(carbamothioylhydrazinylidene)-6-(furan-2-yl)-N-(2-nitrophenyl)-6-oxidanylidene-hexanamide Openeye Name: (4E)-4-(carbamothioylhydrazono)-6-(2-furyl)-N-(2-nitrophenyl)-6-oxo-hexanamide CAS Name: (4E)-4-(carbamothioylhydrazinylidene)-6-(2-furanyl)-N-(2-nitrophenyl)-6-oxohexanamide IUPAC Name: (4E)-4-(carbamothioylhydrazinylidene)-6-(furan-2-yl)-N-(2-nitrophenyl)-6-oxohexanamide Traditional Name: (4E)-6-(2-furyl)-6-keto-N-(2-nitrophenyl)-4-(thiocarbamoylhydrazono)hexanamide Formula: C17H17N5O5S MolecularWeight: 403.41238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCC(=NNC(=S)N)CC(=O)C2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CC/C(=N\NC(=S)N)/CC(=O)C2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O5S/c18-17(28)21-20-11(10-14(23)15-6-3-9-27-15)7-8-16(24)19-12-4-1-2-5-13(12)22(25)26/h1-6,9H,7-8,10H2,(H,19,24)(H3,18,21,28)/b20-11+