(phenylmethyl) N-[[6-(methylcarbamoyl)pyridin-2-yl]methylcarbamothioyl]carbamate

Systemtic Name: (phenylmethyl) N-[[6-(methylcarbamoyl)pyridin-2-yl]methylcarbamothioyl]carbamate Openeye Name: benzyl N-[[6-(methylcarbamoyl)-2-pyridyl]methylcarbamothioyl]carbamate CAS Name: N-[[[6-(methylcarbamoyl)-2-pyridinyl]methylamino]-sulfanylidenemethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[[6-(methylcarbamoyl)pyridin-2-yl]methylcarbamothioyl]carbamate Traditional Name: N-[[6-(methylcarbamoyl)-2-pyridyl]methylthiocarbamoyl]carbamic acid benzyl ester Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC(=CC=C1)CNC(=S)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CNC(=O)C1=NC(=CC=C1)CNC(=S)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H18N4O3S/c1-18-15(22)14-9-5-8-13(20-14)10-19-16(25)21-17(23)24-11-12-6-3-2-4-7-12/h2-9H,10-11H2,1H3,(H,18,22)(H2,19,21,23,25)