6-phenyl-5-propyl-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 6-phenyl-5-propyl-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 6-phenyl-5-propyl-2-thioxo-hexahydropyrimidin-4-one CAS Name: 6-phenyl-5-propyl-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 6-phenyl-5-propyl-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 6-phenyl-5-propyl-2-thioxo-hexahydropyrimidin-4-one Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(NC(=S)NC1=O)C2=CC=CC=C2

Isomeric SMILES

CCCC1C(NC(=S)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C13H16N2OS/c1-2-6-10-11(9-7-4-3-5-8-9)14-13(17)15-12(10)16/h3-5,7-8,10-11H,2,6H2,1H3,(H2,14,15,16,17)