N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[[(2-iodobenzoyl)amino]carbamothioyl]pyridine-3-carboxamide CAS Name: N-[[[(2-iodophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[[(2-iodobenzoyl)amino]carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[[(2-iodobenzoyl)amino]thiocarbamoyl]nicotinamide Formula: C14H11IN4O2S MolecularWeight: 426.23221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC(=S)NC(=O)C2=CN=CC=C2)I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC(=S)NC(=O)C2=CN=CC=C2)I

InChI

InChI=1S/C14H11IN4O2S/c15-11-6-2-1-5-10(11)13(21)18-19-14(22)17-12(20)9-4-3-7-16-8-9/h1-8H,(H,18,21)(H2,17,19,20,22)