3,4,5-trimethoxy-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide Traditional Name: N-(isonicotinamidothiocarbamoyl)-3,4,5-trimethoxy-benzamide Formula: C17H18N4O5S MolecularWeight: 390.41362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C17H18N4O5S/c1-24-12-8-11(9-13(25-2)14(12)26-3)15(22)19-17(27)21-20-16(23)10-4-6-18-7-5-10/h4-9H,1-3H3,(H,20,23)(H2,19,21,22,27)