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

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

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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(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H19ClN4O4S/c24-18-11-10-16(14-20(18)28(31)32)21(29)27-23(33)26-19-9-5-4-8-17(19)22(30)25-13-12-15-6-2-1-3-7-15/h1-11,14H,12-13H2,(H,25,30)(H2,26,27,29,33)