2-butylsulfanyl-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-butylsulfanyl-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(butylthio)-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(butylthio)-5-(4-fluorobenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C16H19FN2OS MolecularWeight: 306.398263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)F

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN2OS/c1-3-4-9-21-16-18-11(2)14(15(20)19-16)10-12-5-7-13(17)8-6-12/h5-8H,3-4,9-10H2,1-2H3,(H,18,19,20)