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

Systemtic Name: N-[(2-chlorophenyl)methylcarbamothioyl]-3-nitro-benzamide Openeye Name: N-[(2-chlorophenyl)methylcarbamothioyl]-3-nitro-benzamide CAS Name: N-[[(2-chlorophenyl)methylamino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(2-chlorophenyl)methylcarbamothioyl]-3-nitrobenzamide Traditional Name: N-[(2-chlorobenzyl)thiocarbamoyl]-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(=CC=C2)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

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