N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[(2-chloro-4-iodo-phenyl)carbamothioyl]pyridine-3-carboxamide CAS Name: N-[(2-chloro-4-iodoanilino)-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[(2-chloro-4-iodophenyl)carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[(2-chloro-4-iodo-phenyl)thiocarbamoyl]nicotinamide Formula: C13H9ClIN3OS MolecularWeight: 417.65253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)Cl

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)Cl

InChI

InChI=1S/C13H9ClIN3OS/c14-10-6-9(15)3-4-11(10)17-13(20)18-12(19)8-2-1-5-16-7-8/h1-7H,(H2,17,18,19,20)