1-(4-phenoxyphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-phenoxyphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-phenoxyphenyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(4-phenoxyphenyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(4-phenoxyphenyl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(4-phenoxyphenyl)-2-(2-pyrimidylthio)ethanone Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C18H14N2O2S/c21-17(13-23-18-19-11-4-12-20-18)14-7-9-16(10-8-14)22-15-5-2-1-3-6-15/h1-12H,13H2