5-(diphenylmethyl)-4-oxidanyl-2-phenacylsulfanyl-1H-pyrimidin-6-one

Systemtic Name: 5-(diphenylmethyl)-4-oxidanyl-2-phenacylsulfanyl-1H-pyrimidin-6-one Openeye Name: 5-benzhydryl-4-hydroxy-2-phenacylsulfanyl-1H-pyrimidin-6-one CAS Name: 5-(diphenylmethyl)-4-hydroxy-2-(phenacylthio)-1H-pyrimidin-6-one IUPAC Name: 5-benzhydryl-4-hydroxy-2-phenacylsulfanyl-1H-pyrimidin-6-one Traditional Name: 5-benzhydryl-4-hydroxy-2-(phenacylthio)-1H-pyrimidin-6-one Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=C(N=C(NC3=O)SCC(=O)C4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=C(N=C(NC3=O)SCC(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C25H20N2O3S/c28-20(17-10-4-1-5-11-17)16-31-25-26-23(29)22(24(30)27-25)21(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,21H,16H2,(H2,26,27,29,30)