4-(2-methylpropoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide

Systemtic Name: 4-(2-methylpropoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 4-isobutoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide CAS Name: 4-(2-methylpropoxy)-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(2-methylpropoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide Traditional Name: 4-isobutoxy-N-(isonicotinamidothiocarbamoyl)benzamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O3S/c1-12(2)11-25-15-5-3-13(4-6-15)16(23)20-18(26)22-21-17(24)14-7-9-19-10-8-14/h3-10,12H,11H2,1-2H3,(H,21,24)(H2,20,22,23,26)