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

Systemtic Name: 4-chloranyl-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[[3-(hydroxymethyl)anilino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(3-methylolphenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C15H12ClN3O4S MolecularWeight: 365.79148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN3O4S/c16-12-5-4-10(7-13(12)19(22)23)14(21)18-15(24)17-11-3-1-2-9(6-11)8-20/h1-7,20H,8H2,(H2,17,18,21,24)