(E)-3-(furan-2-yl)-N-[(5-iodanyl-3-methyl-pyridin-2-yl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(furan-2-yl)-N-[(5-iodanyl-3-methyl-pyridin-2-yl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-furyl)-N-[(5-iodo-3-methyl-2-pyridyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-furanyl)-N-[[(5-iodo-3-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(furan-2-yl)-N-[(5-iodo-3-methylpyridin-2-yl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-furyl)-N-[(5-iodo-3-methyl-2-pyridyl)thiocarbamoyl]acrylamide Formula: C14H12IN3O2S MolecularWeight: 413.23345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1NC(=S)NC(=O)C=CC2=CC=CO2)I

Isomeric SMILES

CC1=CC(=CN=C1NC(=S)NC(=O)/C=C/C2=CC=CO2)I

InChI

InChI=1S/C14H12IN3O2S/c1-9-7-10(15)8-16-13(9)18-14(21)17-12(19)5-4-11-3-2-6-20-11/h2-8H,1H3,(H2,16,17,18,19,21)/b5-4+