N-[(3-chlorophenyl)carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[(3-chlorophenyl)carbamothioyl]-2-nitro-benzamide Openeye Name: N-[(3-chlorophenyl)carbamothioyl]-2-nitro-benzamide CAS Name: N-[(3-chloroanilino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(3-chlorophenyl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[(3-chlorophenyl)thiocarbamoyl]-2-nitro-benzamide Formula: C14H10ClN3O3S MolecularWeight: 335.7655

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H10ClN3O3S/c15-9-4-3-5-10(8-9)16-14(22)17-13(19)11-6-1-2-7-12(11)18(20)21/h1-8H,(H2,16,17,19,22)