3-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide

Systemtic Name: 3-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide Openeye Name: 3-nitro-N-(5-quinolylcarbamothioyl)benzamide CAS Name: 3-nitro-N-[(5-quinolinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-nitro-N-(quinolin-5-ylcarbamothioyl)benzamide Traditional Name: 3-nitro-N-(5-quinolylthiocarbamoyl)benzamide Formula: C17H12N4O3S MolecularWeight: 352.36718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3

InChI

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