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

Systemtic Name: 3-iodanyl-N-(quinolin-8-ylcarbamothioyl)benzamide Openeye Name: 3-iodo-N-(8-quinolylcarbamothioyl)benzamide CAS Name: 3-iodo-N-[(8-quinolinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-N-(quinolin-8-ylcarbamothioyl)benzamide Traditional Name: 3-iodo-N-(8-quinolylthiocarbamoyl)benzamide Formula: C17H12IN3OS MolecularWeight: 433.26615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=S)NC(=O)C3=CC(=CC=C3)I)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=S)NC(=O)C3=CC(=CC=C3)I)N=CC=C2

InChI

InChI=1S/C17H12IN3OS/c18-13-7-1-5-12(10-13)16(22)21-17(23)20-14-8-2-4-11-6-3-9-19-15(11)14/h1-10H,(H2,20,21,22,23)