5-[(3-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-[(3-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(3-chlorophenyl)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(3-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(3-chlorophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(3-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(=C1)Cl)CC2=CNC(=S)NC2=O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CC2=CNC(=S)NC2=O

InChI

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