6-methyl-2-pentylsulfanyl-5-prop-2-enyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-pentylsulfanyl-5-prop-2-enyl-1H-pyrimidin-4-one Openeye Name: 5-allyl-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-(pentylthio)-5-prop-2-enyl-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-pentylsulfanyl-5-prop-2-enyl-1H-pyrimidin-4-one Traditional Name: 5-allyl-2-(amylthio)-6-methyl-1H-pyrimidin-4-one Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC(=O)C(=C(N1)C)CC=C

Isomeric SMILES

CCCCCSC1=NC(=O)C(=C(N1)C)CC=C

InChI

InChI=1S/C13H20N2OS/c1-4-6-7-9-17-13-14-10(3)11(8-5-2)12(16)15-13/h5H,2,4,6-9H2,1,3H3,(H,14,15,16)