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

Systemtic Name: 5-[(3-phenylmethoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(3-benzyloxyphenyl)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(3-phenylmethoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(3-phenylmethoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(3-benzoxybenzyl)-2-thioxo-1H-pyrimidin-4-one Formula: C18H16N2O2S MolecularWeight: 324.39684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)CC3=CNC(=S)NC3=O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)CC3=CNC(=S)NC3=O

InChI

InChI=1S/C18H16N2O2S/c21-17-15(11-19-18(23)20-17)9-14-7-4-8-16(10-14)22-12-13-5-2-1-3-6-13/h1-8,10-11H,9,12H2,(H2,19,20,21,23)