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

Systemtic Name: 5-bromanyl-2-methoxy-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 5-bromo-2-methoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide CAS Name: 5-bromo-2-methoxy-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-methoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide Traditional Name: 5-bromo-N-(isonicotinamidothiocarbamoyl)-2-methoxy-benzamide Formula: C15H13BrN4O3S MolecularWeight: 409.25772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C15H13BrN4O3S/c1-23-12-3-2-10(16)8-11(12)14(22)18-15(24)20-19-13(21)9-4-6-17-7-5-9/h2-8H,1H3,(H,19,21)(H2,18,20,22,24)