(E)-3-(5-methylfuran-2-yl)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(5-methylfuran-2-yl)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(5-methyl-2-furyl)-N-[(pyridine-4-carbonylamino)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(5-methyl-2-furanyl)-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(5-methylfuran-2-yl)-N-[(pyridine-4-carbonylamino)carbamothioyl]prop-2-enamide Traditional Name: (E)-N-(isonicotinamidothiocarbamoyl)-3-(5-methyl-2-furyl)acrylamide Formula: C15H14N4O3S MolecularWeight: 330.36166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=CC(=O)NC(=S)NNC(=O)C2=CC=NC=C2

Isomeric SMILES

CC1=CC=C(O1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C15H14N4O3S/c1-10-2-3-12(22-10)4-5-13(20)17-15(23)19-18-14(21)11-6-8-16-9-7-11/h2-9H,1H3,(H,18,21)(H2,17,19,20,23)/b5-4+