5-[(4-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(4-chlorophenyl)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(4-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(4-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(4-chlorobenzyl)-2-thioxo-1H-pyrimidin-4-one Formula: C11H9ClN2OS MolecularWeight: 252.71996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CNC(=S)NC2=O)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=CNC(=S)NC2=O)Cl

InChI

InChI=1S/C11H9ClN2OS/c12-9-3-1-7(2-4-9)5-8-6-13-11(16)14-10(8)15/h1-4,6H,5H2,(H2,13,14,15,16)