3,5-dinitro-N-[[2-(phenethylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,5-dinitro-N-[[2-(phenethylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dinitro-N-[[2-(phenethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dinitro-N-[[2-[oxo-(phenethylamino)methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dinitro-N-[[2-(phenethylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dinitro-N-[[2-(phenethylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C23H19N5O6S MolecularWeight: 493.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O6S/c29-21(16-12-17(27(31)32)14-18(13-16)28(33)34)26-23(35)25-20-9-5-4-8-19(20)22(30)24-11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,24,30)(H2,25,26,29,35)