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

Systemtic Name: N-[(5-iodanylpyridin-2-yl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(5-iodo-2-pyridyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[(5-iodo-2-pyridinyl)amino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(5-iodopyridin-2-yl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(5-iodo-2-pyridyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C16H16IN3O2S MolecularWeight: 441.28661

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)I

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)I

InChI

InChI=1S/C16H16IN3O2S/c1-2-8-22-13-5-3-4-11(9-13)15(21)20-16(23)19-14-7-6-12(17)10-18-14/h3-7,9-10H,2,8H2,1H3,(H2,18,19,20,21,23)