3-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C16H16N6O2S MolecularWeight: 356.40224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C16H16N6O2S/c23-13(10-22-11-19-14-12(15(22)24)2-9-25-14)20-5-7-21(8-6-20)16-17-3-1-4-18-16/h1-4,9,11H,5-8,10H2