6-chloranyl-N-[(4,6-diethoxypyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 6-chloranyl-N-[(4,6-diethoxypyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 6-chloro-N-[(4,6-diethoxypyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide CAS Name: 6-chloro-N-[[(4,6-diethoxy-2-pyrimidinyl)amino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 6-chloro-N-[(4,6-diethoxypyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 6-chloro-N-[(4,6-diethoxypyrimidin-2-yl)thiocarbamoyl]nicotinamide Formula: C15H16ClN5O3S MolecularWeight: 381.83724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CN=C(C=C2)Cl)OCC

Isomeric SMILES

CCOC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CN=C(C=C2)Cl)OCC

InChI

InChI=1S/C15H16ClN5O3S/c1-3-23-11-7-12(24-4-2)19-14(18-11)21-15(25)20-13(22)9-5-6-10(16)17-8-9/h5-8H,3-4H2,1-2H3,(H2,18,19,20,21,22,25)