(3E)-3-(carbamothioylhydrazinylidene)-N-(3-nitrophenyl)butanamide

Systemtic Name: (3E)-3-(carbamothioylhydrazinylidene)-N-(3-nitrophenyl)butanamide Openeye Name: (3E)-3-(carbamothioylhydrazono)-N-(3-nitrophenyl)butanamide CAS Name: (3E)-3-(carbamothioylhydrazinylidene)-N-(3-nitrophenyl)butanamide IUPAC Name: (3E)-3-(carbamothioylhydrazinylidene)-N-(3-nitrophenyl)butanamide Traditional Name: (3E)-N-(3-nitrophenyl)-3-(thiocarbamoylhydrazono)butyramide Formula: C11H13N5O3S MolecularWeight: 295.31762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N)CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=S)N)/CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H13N5O3S/c1-7(14-15-11(12)20)5-10(17)13-8-3-2-4-9(6-8)16(18)19/h2-4,6H,5H2,1H3,(H,13,17)(H3,12,15,20)/b14-7+