N-[[3,5-bis(bromanyl)pyridin-2-yl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: N-[[3,5-bis(bromanyl)pyridin-2-yl]carbamothioyl]-4-methyl-benzamide Openeye Name: N-[(3,5-dibromo-2-pyridyl)carbamothioyl]-4-methyl-benzamide CAS Name: N-[[(3,5-dibromo-2-pyridinyl)amino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[(3,5-dibromopyridin-2-yl)carbamothioyl]-4-methylbenzamide Traditional Name: N-[(3,5-dibromo-2-pyridyl)thiocarbamoyl]-4-methyl-benzamide Formula: C14H11Br2N3OS MolecularWeight: 429.12964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=N2)Br)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=N2)Br)Br

InChI

InChI=1S/C14H11Br2N3OS/c1-8-2-4-9(5-3-8)13(20)19-14(21)18-12-11(16)6-10(15)7-17-12/h2-7H,1H3,(H2,17,18,19,20,21)