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

Systemtic Name: N-[(5-iodanylpyridin-2-yl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(5-iodo-2-pyridyl)carbamothioyl]benzamide CAS Name: N-[[(5-iodo-2-pyridinyl)amino]-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(5-iodopyridin-2-yl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(5-iodo-2-pyridyl)thiocarbamoyl]benzamide Formula: C20H16IN3O2S MolecularWeight: 489.32941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=NC=C(C=C3)I

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=NC=C(C=C3)I

InChI

InChI=1S/C20H16IN3O2S/c21-16-9-10-18(22-12-16)23-20(27)24-19(25)15-7-4-8-17(11-15)26-13-14-5-2-1-3-6-14/h1-12H,13H2,(H2,22,23,24,25,27)