5-prop-2-enyl-6-propyl-2-prop-2-ynylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5-prop-2-enyl-6-propyl-2-prop-2-ynylsulfanyl-1H-pyrimidin-4-one Openeye Name: 5-allyl-6-propyl-2-prop-2-ynylsulfanyl-1H-pyrimidin-4-one CAS Name: 5-prop-2-enyl-6-propyl-2-(prop-2-ynylthio)-1H-pyrimidin-4-one IUPAC Name: 5-prop-2-enyl-6-propyl-2-prop-2-ynylsulfanyl-1H-pyrimidin-4-one Traditional Name: 5-allyl-2-(propargylthio)-6-propyl-1H-pyrimidin-4-one Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N=C(N1)SCC#C)CC=C

Isomeric SMILES

CCCC1=C(C(=O)N=C(N1)SCC#C)CC=C

InChI

InChI=1S/C13H16N2OS/c1-4-7-10-11(8-5-2)14-13(15-12(10)16)17-9-6-3/h3-4H,1,5,7-9H2,2H3,(H,14,15,16)