5-bromanyl-2-chloranyl-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 5-bromo-2-chloro-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide CAS Name: 5-bromo-2-chloro-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide Traditional Name: 5-bromo-2-chloro-N-(isonicotinamidothiocarbamoyl)benzamide Formula: C14H10BrClN4O2S MolecularWeight: 413.6768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Cl

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Cl

InChI

InChI=1S/C14H10BrClN4O2S/c15-9-1-2-11(16)10(7-9)13(22)18-14(23)20-19-12(21)8-3-5-17-6-4-8/h1-7H,(H,19,21)(H2,18,20,22,23)