N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3,4-dimethoxy-benzamide Openeye Name: N-[(5-bromo-2-pyridyl)carbamothioyl]-3,4-dimethoxy-benzamide CAS Name: N-[[(5-bromo-2-pyridinyl)amino]-sulfanylidenemethyl]-3,4-dimethoxybenzamide IUPAC Name: N-[(5-bromopyridin-2-yl)carbamothioyl]-3,4-dimethoxybenzamide Traditional Name: N-[(5-bromo-2-pyridyl)thiocarbamoyl]-3,4-dimethoxy-benzamide Formula: C15H14BrN3O3S MolecularWeight: 396.25896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br)OC

InChI

InChI=1S/C15H14BrN3O3S/c1-21-11-5-3-9(7-12(11)22-2)14(20)19-15(23)18-13-6-4-10(16)8-17-13/h3-8H,1-2H3,(H2,17,18,19,20,23)