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

Systemtic Name: (E)-N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[(5-bromo-6-methyl-2-pyridyl)carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[[(5-bromo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(5-bromo-6-methylpyridin-2-yl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(5-bromo-6-methyl-2-pyridyl)thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C20H16BrN3O2S MolecularWeight: 442.32894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=N1)NC(=S)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3)Br

InChI

InChI=1S/C20H16BrN3O2S/c1-13-16(21)9-11-18(22-13)23-20(27)24-19(25)12-8-15-7-10-17(26-15)14-5-3-2-4-6-14/h2-12H,1H3,(H2,22,23,24,25,27)/b12-8+