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

Systemtic Name: 5-[2-(3-methoxypyridin-2-yl)propyl]-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-[2-(3-methoxy-2-pyridyl)propyl]-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one CAS Name: 5-[2-(3-methoxy-2-pyridinyl)propyl]-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-[2-(3-methoxypyridin-2-yl)propyl]-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-[2-(3-methoxy-2-pyridyl)propyl]-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-1H-pyrimidin-6-one Formula: C20H26N6O2S MolecularWeight: 414.52444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CC(C)C3=C(C=CC=N3)OC

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=NC=C(C(=O)N2)CC(C)C3=C(C=CC=N3)OC

InChI

InChI=1S/C20H26N6O2S/c1-13(18-17(28-3)5-4-6-21-18)9-15-10-23-20(26-19(15)27)22-7-8-29-11-16-14(2)24-12-25-16/h4-6,10,12-13H,7-9,11H2,1-3H3,(H,24,25)(H2,22,23,26,27)