2-cyclopentylsulfanyl-6-(1-phenylpropyl)-1H-pyrimidin-4-one

Systemtic Name: 2-cyclopentylsulfanyl-6-(1-phenylpropyl)-1H-pyrimidin-4-one Openeye Name: 2-cyclopentylsulfanyl-6-(1-phenylpropyl)-1H-pyrimidin-4-one CAS Name: 2-(cyclopentylthio)-6-(1-phenylpropyl)-1H-pyrimidin-4-one IUPAC Name: 2-cyclopentylsulfanyl-6-(1-phenylpropyl)-1H-pyrimidin-4-one Traditional Name: 2-(cyclopentylthio)-6-(1-phenylpropyl)-1H-pyrimidin-4-one Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C2=CC(=O)N=C(N2)SC3CCCC3

Isomeric SMILES

CCC(C1=CC=CC=C1)C2=CC(=O)N=C(N2)SC3CCCC3

InChI

InChI=1S/C18H22N2OS/c1-2-15(13-8-4-3-5-9-13)16-12-17(21)20-18(19-16)22-14-10-6-7-11-14/h3-5,8-9,12,14-15H,2,6-7,10-11H2,1H3,(H,19,20,21)