6-(1-phenylpropyl)-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-(1-phenylpropyl)-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one Openeye Name: 2-isopropylsulfanyl-6-(1-phenylpropyl)-1H-pyrimidin-4-one CAS Name: 6-(1-phenylpropyl)-2-(propan-2-ylthio)-1H-pyrimidin-4-one IUPAC Name: 6-(1-phenylpropyl)-2-propan-2-ylsulfanyl-1H-pyrimidin-4-one Traditional Name: 2-(isopropylthio)-6-(1-phenylpropyl)-1H-pyrimidin-4-one Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C2=CC(=O)N=C(N2)SC(C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C2=CC(=O)N=C(N2)SC(C)C

InChI

InChI=1S/C16H20N2OS/c1-4-13(12-8-6-5-7-9-12)14-10-15(19)18-16(17-14)20-11(2)3/h5-11,13H,4H2,1-3H3,(H,17,18,19)