5-phenethyl-2-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-phenethyl-2-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-phenethyl-2-[2-(2-pyridylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one CAS Name: 5-phenethyl-2-[2-(2-pyridinylmethylthio)ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-phenethyl-2-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-phenethyl-2-[2-(2-pyridylmethylthio)ethylamino]-1H-pyrimidin-6-one Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CN=C(NC2=O)NCCSCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CN=C(NC2=O)NCCSCC3=CC=CC=N3

InChI

InChI=1S/C20H22N4OS/c25-19-17(10-9-16-6-2-1-3-7-16)14-23-20(24-19)22-12-13-26-15-18-8-4-5-11-21-18/h1-8,11,14H,9-10,12-13,15H2,(H2,22,23,24,25)