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

Systemtic Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-(2-pyridin-3-ylsulfanylethyl)-1H-pyrimidin-6-one Openeye Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[2-(3-pyridylsulfanyl)ethyl]-1H-pyrimidin-6-one CAS Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-5-[2-(3-pyridinylthio)ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-(2-pyridin-3-ylsulfanylethyl)-1H-pyrimidin-6-one Traditional Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-5-[2-(3-pyridylthio)ethyl]-1H-pyrimidin-6-one Formula: C18H22N6OS2 MolecularWeight: 402.53688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CCSC3=CN=CC=C3

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CCSC3=CN=CC=C3

InChI

InChI=1S/C18H22N6OS2/c1-13-16(23-12-22-13)11-26-8-6-20-18-21-9-14(17(25)24-18)4-7-27-15-3-2-5-19-10-15/h2-3,5,9-10,12H,4,6-8,11H2,1H3,(H,22,23)(H2,20,21,24,25)