N-[(5-iodanyl-3-methyl-pyridin-2-yl)carbamothioyl]-4-phenylmethoxy-benzamide

Systemtic Name: N-[(5-iodanyl-3-methyl-pyridin-2-yl)carbamothioyl]-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-[(5-iodo-3-methyl-2-pyridyl)carbamothioyl]benzamide CAS Name: N-[[(5-iodo-3-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-4-phenylmethoxybenzamide IUPAC Name: N-[(5-iodo-3-methylpyridin-2-yl)carbamothioyl]-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-[(5-iodo-3-methyl-2-pyridyl)thiocarbamoyl]benzamide Formula: C21H18IN3O2S MolecularWeight: 503.35599

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)I

Isomeric SMILES

CC1=CC(=CN=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)I

InChI

InChI=1S/C21H18IN3O2S/c1-14-11-17(22)12-23-19(14)24-21(28)25-20(26)16-7-9-18(10-8-16)27-13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H2,23,24,25,26,28)