2-(3-methylphenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(3-methylphenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide Openeye Name: 2-(3-methylphenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide CAS Name: 2-(3-methylphenoxy)-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(3-methylphenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide Traditional Name: N-(isonicotinamidothiocarbamoyl)-2-(3-methylphenoxy)acetamide Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C16H16N4O3S/c1-11-3-2-4-13(9-11)23-10-14(21)18-16(24)20-19-15(22)12-5-7-17-8-6-12/h2-9H,10H2,1H3,(H,19,22)(H2,18,20,21,24)