4-hexoxy-N-[(5-iodanylpyridin-2-yl)carbamothioyl]benzamide

Systemtic Name: 4-hexoxy-N-[(5-iodanylpyridin-2-yl)carbamothioyl]benzamide Openeye Name: 4-hexoxy-N-[(5-iodo-2-pyridyl)carbamothioyl]benzamide CAS Name: 4-hexoxy-N-[[(5-iodo-2-pyridinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-hexoxy-N-[(5-iodopyridin-2-yl)carbamothioyl]benzamide Traditional Name: 4-hexoxy-N-[(5-iodo-2-pyridyl)thiocarbamoyl]benzamide Formula: C19H22IN3O2S MolecularWeight: 483.36635

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)I

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)I

InChI

InChI=1S/C19H22IN3O2S/c1-2-3-4-5-12-25-16-9-6-14(7-10-16)18(24)23-19(26)22-17-11-8-15(20)13-21-17/h6-11,13H,2-5,12H2,1H3,(H2,21,22,23,24,26)