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

Systemtic Name: 2-cyclopentylsulfanyl-6-(1-phenylethyl)-1H-pyrimidin-4-one Openeye Name: 2-cyclopentylsulfanyl-6-(1-phenylethyl)-1H-pyrimidin-4-one CAS Name: 2-(cyclopentylthio)-6-(1-phenylethyl)-1H-pyrimidin-4-one IUPAC Name: 2-cyclopentylsulfanyl-6-(1-phenylethyl)-1H-pyrimidin-4-one Traditional Name: 2-(cyclopentylthio)-6-(1-phenylethyl)-1H-pyrimidin-4-one Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2OS/c1-12(13-7-3-2-4-8-13)15-11-16(20)19-17(18-15)21-14-9-5-6-10-14/h2-4,7-8,11-12,14H,5-6,9-10H2,1H3,(H,18,19,20)