2-methylsulfanyl-6-[[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]methyl]-1H-pyrimidin-4-one

Systemtic Name: 2-methylsulfanyl-6-[[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]methyl]-1H-pyrimidin-4-one Openeye Name: 2-methylsulfanyl-6-[[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]methyl]-1H-pyrimidin-4-one CAS Name: 2-(methylthio)-6-[[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]methyl]-1H-pyrimidin-4-one IUPAC Name: 2-methylsulfanyl-6-[[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]-1H-pyrimidin-4-one Traditional Name: 6-[[4-(2-keto-2-pyrrolidino-ethyl)piperazino]methyl]-2-(methylthio)-1H-pyrimidin-4-one Formula: C16H25N5O2S MolecularWeight: 351.467

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C=C(N1)CN2CCN(CC2)CC(=O)N3CCCC3

Isomeric SMILES

CSC1=NC(=O)C=C(N1)CN2CCN(CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C16H25N5O2S/c1-24-16-17-13(10-14(22)18-16)11-19-6-8-20(9-7-19)12-15(23)21-4-2-3-5-21/h10H,2-9,11-12H2,1H3,(H,17,18,22)