N-[(5-chloranylpyridin-2-yl)carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[(5-chloranylpyridin-2-yl)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[(5-chloro-2-pyridyl)carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[(5-chloro-2-pyridinyl)amino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide Traditional Name: N-[(5-chloro-2-pyridyl)thiocarbamoyl]-2-phenyl-acetamide Formula: C14H12ClN3OS MolecularWeight: 305.78258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=NC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C14H12ClN3OS/c15-11-6-7-12(16-9-11)17-14(20)18-13(19)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H2,16,17,18,19,20)