(E)-3-(furan-2-yl)-N-[(5-iodanyl-6-methyl-pyridin-2-yl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(furan-2-yl)-N-[(5-iodanyl-6-methyl-pyridin-2-yl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-furyl)-N-[(5-iodo-6-methyl-2-pyridyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-furanyl)-N-[[(5-iodo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(furan-2-yl)-N-[(5-iodo-6-methylpyridin-2-yl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-furyl)-N-[(5-iodo-6-methyl-2-pyridyl)thiocarbamoyl]acrylamide Formula: C14H12IN3O2S MolecularWeight: 413.23345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)NC(=S)NC(=O)C=CC2=CC=CO2)I

Isomeric SMILES

CC1=C(C=CC(=N1)NC(=S)NC(=O)/C=C/C2=CC=CO2)I

InChI

InChI=1S/C14H12IN3O2S/c1-9-11(15)5-6-12(16-9)17-14(21)18-13(19)7-4-10-3-2-8-20-10/h2-8H,1H3,(H2,16,17,18,19,21)/b7-4+