5-[[ethyl(phenyl)amino]methyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-[[ethyl(phenyl)amino]methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(N-ethylanilino)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(N-ethylanilino)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(N-ethylanilino)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-[(N-ethylanilino)methyl]-2-thioxo-1H-pyrimidin-4-one Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CNC(=S)NC1=O)C2=CC=CC=C2

Isomeric SMILES

CCN(CC1=CNC(=S)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C13H15N3OS/c1-2-16(11-6-4-3-5-7-11)9-10-8-14-13(18)15-12(10)17/h3-8H,2,9H2,1H3,(H2,14,15,17,18)