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

Systemtic Name: 3,5-bis(bromanyl)-2-methoxy-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 3,5-dibromo-2-methoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide CAS Name: 3,5-dibromo-2-methoxy-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dibromo-2-methoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide Traditional Name: 3,5-dibromo-N-(isonicotinamidothiocarbamoyl)-2-methoxy-benzamide Formula: C15H12Br2N4O3S MolecularWeight: 488.15378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Br)Br

InChI

InChI=1S/C15H12Br2N4O3S/c1-24-12-10(6-9(16)7-11(12)17)14(23)19-15(25)21-20-13(22)8-2-4-18-5-3-8/h2-7H,1H3,(H,20,22)(H2,19,21,23,25)