(E)-N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3-(4-chlorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3-(4-chlorophenyl)prop-2-enamide Openeye Name: (E)-N-[(5-bromo-2-pyridyl)carbamothioyl]-3-(4-chlorophenyl)prop-2-enamide CAS Name: (E)-N-[[(5-bromo-2-pyridinyl)amino]-sulfanylidenemethyl]-3-(4-chlorophenyl)-2-propenamide IUPAC Name: (E)-N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(4-chlorophenyl)prop-2-enamide Traditional Name: (E)-N-[(5-bromo-2-pyridyl)thiocarbamoyl]-3-(4-chlorophenyl)acrylamide Formula: C15H11BrClN3OS MolecularWeight: 396.68934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC(=S)NC2=NC=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NC(=S)NC2=NC=C(C=C2)Br)Cl

InChI

InChI=1S/C15H11BrClN3OS/c16-11-4-7-13(18-9-11)19-15(22)20-14(21)8-3-10-1-5-12(17)6-2-10/h1-9H,(H2,18,19,20,21,22)/b8-3+