1-phenethyl-2-(1-phenylethylsulfanyl)-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one

Systemtic Name: 1-phenethyl-2-(1-phenylethylsulfanyl)-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one Openeye Name: 1-phenethyl-2-(1-phenylethylsulfanyl)-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one CAS Name: 1-phenethyl-2-(1-phenylethylthio)-5-(5-pyrimidinylmethyl)-4-pyrimidinone IUPAC Name: 1-phenethyl-2-(1-phenylethylsulfanyl)-5-(pyrimidin-5-ylmethyl)pyrimidin-4-one Traditional Name: 1-phenethyl-2-(1-phenylethylthio)-5-(5-pyrimidylmethyl)pyrimidin-4-one Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NC(=O)C(=CN2CCC3=CC=CC=C3)CC4=CN=CN=C4

Isomeric SMILES

CC(C1=CC=CC=C1)SC2=NC(=O)C(=CN2CCC3=CC=CC=C3)CC4=CN=CN=C4

InChI

InChI=1S/C25H24N4OS/c1-19(22-10-6-3-7-11-22)31-25-28-24(30)23(14-21-15-26-18-27-16-21)17-29(25)13-12-20-8-4-2-5-9-20/h2-11,15-19H,12-14H2,1H3