1-phenyl-2-(phenylmethylsulfanyl)pyrimidine-4,6-dione

Systemtic Name: 1-phenyl-2-(phenylmethylsulfanyl)pyrimidine-4,6-dione Openeye Name: 2-benzylsulfanyl-1-phenyl-pyrimidine-4,6-dione CAS Name: 1-phenyl-2-(phenylmethylthio)pyrimidine-4,6-dione IUPAC Name: 2-benzylsulfanyl-1-phenylpyrimidine-4,6-dione Traditional Name: 2-(benzylthio)-1-phenyl-pyrimidine-4,6-quinone Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N=C(N(C1=O)C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N=C(N(C1=O)C2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H14N2O2S/c20-15-11-16(21)19(14-9-5-2-6-10-14)17(18-15)22-12-13-7-3-1-4-8-13/h1-10H,11-12H2