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

Systemtic Name: 3,4,5-triethoxy-N-[(5-iodanyl-3-methyl-pyridin-2-yl)carbamothioyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[(5-iodo-3-methyl-2-pyridyl)carbamothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[[(5-iodo-3-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[(5-iodo-3-methylpyridin-2-yl)carbamothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[(5-iodo-3-methyl-2-pyridyl)thiocarbamoyl]benzamide Formula: C20H24IN3O4S MolecularWeight: 529.39173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=NC=C(C=C2C)I

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=NC=C(C=C2C)I

InChI

InChI=1S/C20H24IN3O4S/c1-5-26-15-9-13(10-16(27-6-2)17(15)28-7-3)19(25)24-20(29)23-18-12(4)8-14(21)11-22-18/h8-11H,5-7H2,1-4H3,(H2,22,23,24,25,29)