[4-(azepan-1-yl)-2-methylsulfanyl-pyrimidin-5-yl]methanol

Systemtic Name: [4-(azepan-1-yl)-2-methylsulfanyl-pyrimidin-5-yl]methanol Openeye Name: [4-(azepan-1-yl)-2-methylsulfanyl-pyrimidin-5-yl]methanol CAS Name: [4-(1-azepanyl)-2-(methylthio)-5-pyrimidinyl]methanol IUPAC Name: [4-(azepan-1-yl)-2-methylsulfanylpyrimidin-5-yl]methanol Traditional Name: [4-(azepan-1-yl)-2-(methylthio)pyrimidin-5-yl]methanol Formula: C12H19N3OS MolecularWeight: 253.36376

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)N2CCCCCC2)CO

Isomeric SMILES

CSC1=NC=C(C(=N1)N2CCCCCC2)CO

InChI

InChI=1S/C12H19N3OS/c1-17-12-13-8-10(9-16)11(14-12)15-6-4-2-3-5-7-15/h8,16H,2-7,9H2,1H3