2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[2-(2-pyridin-3-ylethylsulfanyl)ethyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[2-(2-pyridin-3-ylethylsulfanyl)ethyl]-1H-pyrimidin-6-one Openeye Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[2-[2-(3-pyridyl)ethylsulfanyl]ethyl]-1H-pyrimidin-6-one CAS Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-5-[2-[2-(3-pyridinyl)ethylthio]ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[2-(2-pyridin-3-ylethylsulfanyl)ethyl]-1H-pyrimidin-6-one Traditional Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-5-[2-[2-(3-pyridyl)ethylthio]ethyl]-1H-pyrimidin-6-one Formula: C20H26N6OS2 MolecularWeight: 430.59004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CCSCCC3=CN=CC=C3

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CCSCCC3=CN=CC=C3

InChI

InChI=1S/C20H26N6OS2/c1-15-18(25-14-24-15)13-29-10-7-22-20-23-12-17(19(27)26-20)5-9-28-8-4-16-3-2-6-21-11-16/h2-3,6,11-12,14H,4-5,7-10,13H2,1H3,(H,24,25)(H2,22,23,26,27)