2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-6-propyl-1H-pyrimidin-4-one Formula: C14H21N5OS MolecularWeight: 307.41444

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)NCCSCC2=C(NC=N2)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)NCCSCC2=C(NC=N2)C

InChI

InChI=1S/C14H21N5OS/c1-3-4-11-7-13(20)19-14(18-11)15-5-6-21-8-12-10(2)16-9-17-12/h7,9H,3-6,8H2,1-2H3,(H,16,17)(H2,15,18,19,20)