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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=C(C(=O)N=C2SCC(=O)C3=CC=CC=C3)CC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC=CC=C1N2C(=C(C(=O)N=C2SCC(=O)C3=CC=CC=C3)CC4=CC=CC=C4)O

InChI

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