4-chloranyl-N-[(4-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-N-[(4-nitrophenyl)carbamothioyl]benzamide Openeye Name: 4-chloro-N-[(4-nitrophenyl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[(4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[(4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(4-nitrophenyl)thiocarbamoyl]benzamide Formula: C14H10ClN3O3S MolecularWeight: 335.7655

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Cl

InChI

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