N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-4-ethoxy-benzamide

Systemtic Name: N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-4-ethoxy-benzamide Openeye Name: N-[(5-bromo-6-methyl-2-pyridyl)carbamothioyl]-4-ethoxy-benzamide CAS Name: N-[[(5-bromo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: N-[(5-bromo-6-methylpyridin-2-yl)carbamothioyl]-4-ethoxybenzamide Traditional Name: N-[(5-bromo-6-methyl-2-pyridyl)thiocarbamoyl]-4-ethoxy-benzamide Formula: C16H16BrN3O2S MolecularWeight: 394.28614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(C=C2)Br)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(C=C2)Br)C

InChI

InChI=1S/C16H16BrN3O2S/c1-3-22-12-6-4-11(5-7-12)15(21)20-16(23)19-14-9-8-13(17)10(2)18-14/h4-9H,3H2,1-2H3,(H2,18,19,20,21,23)