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N-[(5-iodanylpyridin-2-yl)carbamothioyl]-3-nitro-benzamide

N-[(5-iodanylpyridin-2-yl)carbamothioyl]-3-nitro-benzamide

Systemtic Name:N-[(5-iodanylpyridin-2-yl)carbamothioyl]-3-nitro-benzamide
Openeye Name:N-[(5-iodo-2-pyridyl)carbamothioyl]-3-nitro-benzamide
CAS Name:N-[[(5-iodo-2-pyridinyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide
IUPAC Name:N-[(5-iodopyridin-2-yl)carbamothioyl]-3-nitrobenzamide
Traditional Name:N-[(5-iodo-2-pyridyl)thiocarbamoyl]-3-nitro-benzamide
Formula: C13H9IN4O3S
MolecularWeight: 428.20503
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=NC=C(C=C2)I


Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=NC=C(C=C2)I


InChI

InChI=1S/C13H9IN4O3S/c14-9-4-5-11(15-7-9)16-13(22)17-12(19)8-2-1-3-10(6-8)18(20)21/h1-7H,(H2,15,16,17,19,22)


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