3-nitro-N-(quinolin-8-ylcarbamothioyl)benzamide

Systemtic Name: 3-nitro-N-(quinolin-8-ylcarbamothioyl)benzamide Openeye Name: 3-nitro-N-(8-quinolylcarbamothioyl)benzamide CAS Name: 3-nitro-N-[(8-quinolinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-nitro-N-(quinolin-8-ylcarbamothioyl)benzamide Traditional Name: 3-nitro-N-(8-quinolylthiocarbamoyl)benzamide Formula: C17H12N4O3S MolecularWeight: 352.36718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=CC=C2

InChI

InChI=1S/C17H12N4O3S/c22-16(12-5-1-7-13(10-12)21(23)24)20-17(25)19-14-8-2-4-11-6-3-9-18-15(11)14/h1-10H,(H2,19,20,22,25)