2-chloranyl-N-[(4-chloranyl-6-ethoxy-pyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[(4-chloranyl-6-ethoxy-pyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[(4-chloro-6-ethoxy-pyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[[(4-chloro-6-ethoxy-2-pyrimidinyl)amino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[(4-chloro-6-ethoxypyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[(4-chloro-6-ethoxy-pyrimidin-2-yl)thiocarbamoyl]nicotinamide Formula: C13H11Cl2N5O2S MolecularWeight: 372.22974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11Cl2N5O2S/c1-2-22-9-6-8(14)17-12(18-9)20-13(23)19-11(21)7-4-3-5-16-10(7)15/h3-6H,2H2,1H3,(H2,17,18,19,20,21,23)