4-chloranyl-3-nitro-N-[[2-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[[2-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[[2-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 4-chloro-3-nitro-N-[[2-[oxo-(1-phenylethylamino)methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[[2-(1-phenylethylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[[2-(1-phenylethylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C23H19ClN4O4S MolecularWeight: 482.93936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19ClN4O4S/c1-14(15-7-3-2-4-8-15)25-22(30)17-9-5-6-10-19(17)26-23(33)27-21(29)16-11-12-18(24)20(13-16)28(31)32/h2-14H,1H3,(H,25,30)(H2,26,27,29,33)