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

Systemtic Name: 4-chloranyl-3-nitro-N-[(phenylmethyl)carbamothioyl]benzamide Openeye Name: N-(benzylcarbamothioyl)-4-chloro-3-nitro-benzamide CAS Name: 4-chloro-3-nitro-N-[[(phenylmethyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-(benzylcarbamothioyl)-4-chloro-3-nitrobenzamide Traditional Name: N-(benzylthiocarbamoyl)-4-chloro-3-nitro-benzamide Formula: C15H12ClN3O3S MolecularWeight: 349.79208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN3O3S/c16-12-7-6-11(8-13(12)19(21)22)14(20)18-15(23)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,17,18,20,23)