N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3-methyl-benzamide

Systemtic Name: N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3-methyl-benzamide Openeye Name: N-[(5-bromo-2-pyridyl)carbamothioyl]-3-methyl-benzamide CAS Name: N-[[(5-bromo-2-pyridinyl)amino]-sulfanylidenemethyl]-3-methylbenzamide IUPAC Name: N-[(5-bromopyridin-2-yl)carbamothioyl]-3-methylbenzamide Traditional Name: N-[(5-bromo-2-pyridyl)thiocarbamoyl]-3-methyl-benzamide Formula: C14H12BrN3OS MolecularWeight: 350.23358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br

InChI

InChI=1S/C14H12BrN3OS/c1-9-3-2-4-10(7-9)13(19)18-14(20)17-12-6-5-11(15)8-16-12/h2-8H,1H3,(H2,16,17,18,19,20)