1-(2-phenoxyethyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(2-phenoxyethyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(2-phenoxyethyl)-5-(pyrimidin-5-ylmethyl)-2-thioxo-pyrimidin-4-one CAS Name: 1-(2-phenoxyethyl)-5-(5-pyrimidinylmethyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(2-phenoxyethyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-(2-phenoxyethyl)-5-(5-pyrimidylmethyl)-2-thioxo-pyrimidin-4-one Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C=C(C(=O)NC2=S)CC3=CN=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C=C(C(=O)NC2=S)CC3=CN=CN=C3

InChI

InChI=1S/C17H16N4O2S/c22-16-14(8-13-9-18-12-19-10-13)11-21(17(24)20-16)6-7-23-15-4-2-1-3-5-15/h1-5,9-12H,6-8H2,(H,20,22,24)