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

Systemtic Name: 1-(4-ethanoylphenyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(4-acetylphenyl)-5-(pyrimidin-5-ylmethyl)-2-thioxo-pyrimidin-4-one CAS Name: 1-(4-acetylphenyl)-5-(5-pyrimidinylmethyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(4-acetylphenyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-(4-acetylphenyl)-5-(5-pyrimidylmethyl)-2-thioxo-pyrimidin-4-one Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C=C(C(=O)NC2=S)CC3=CN=CN=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C=C(C(=O)NC2=S)CC3=CN=CN=C3

InChI

InChI=1S/C17H14N4O2S/c1-11(22)13-2-4-15(5-3-13)21-9-14(16(23)20-17(21)24)6-12-7-18-10-19-8-12/h2-5,7-10H,6H2,1H3,(H,20,23,24)