2-phenyl-5,5-bis[2-(phenylmethylsulfanyl)ethyl]-1H-pyrimidine-4,6-dione

Systemtic Name: 2-phenyl-5,5-bis[2-(phenylmethylsulfanyl)ethyl]-1H-pyrimidine-4,6-dione Openeye Name: 5,5-bis(2-benzylsulfanylethyl)-2-phenyl-1H-pyrimidine-4,6-dione CAS Name: 2-phenyl-5,5-bis[2-(phenylmethylthio)ethyl]-1H-pyrimidine-4,6-dione IUPAC Name: 5,5-bis(2-benzylsulfanylethyl)-2-phenyl-1H-pyrimidine-4,6-dione Traditional Name: 5,5-bis[2-(benzylthio)ethyl]-2-phenyl-1H-pyrimidine-4,6-quinone Formula: C28H28N2O2S2 MolecularWeight: 488.66412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC2(C(=O)NC(=NC2=O)C3=CC=CC=C3)CCSCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSCCC2(C(=O)NC(=NC2=O)C3=CC=CC=C3)CCSCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O2S2/c31-26-28(16-18-33-20-22-10-4-1-5-11-22,17-19-34-21-23-12-6-2-7-13-23)27(32)30-25(29-26)24-14-8-3-9-15-24/h1-15H,16-21H2,(H,29,30,31,32)