1-(4-methoxyphenyl)-6-oxidanyl-2-phenacylsulfanyl-5-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 1-(4-methoxyphenyl)-6-oxidanyl-2-phenacylsulfanyl-5-(phenylmethyl)pyrimidin-4-one Openeye Name: 5-benzyl-6-hydroxy-1-(4-methoxyphenyl)-2-phenacylsulfanyl-pyrimidin-4-one CAS Name: 6-hydroxy-1-(4-methoxyphenyl)-2-(phenacylthio)-5-(phenylmethyl)-4-pyrimidinone IUPAC Name: 5-benzyl-6-hydroxy-1-(4-methoxyphenyl)-2-phenacylsulfanylpyrimidin-4-one Traditional Name: 5-benzyl-6-hydroxy-1-(4-methoxyphenyl)-2-(phenacylthio)pyrimidin-4-one Formula: C26H22N2O4S MolecularWeight: 458.52888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(C(=O)N=C2SCC(=O)C3=CC=CC=C3)CC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(C(=O)N=C2SCC(=O)C3=CC=CC=C3)CC4=CC=CC=C4)O

InChI

InChI=1S/C26H22N2O4S/c1-32-21-14-12-20(13-15-21)28-25(31)22(16-18-8-4-2-5-9-18)24(30)27-26(28)33-17-23(29)19-10-6-3-7-11-19/h2-15,31H,16-17H2,1H3