2-[2-[(4-methylpyridin-2-yl)methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[2-[(4-methylpyridin-2-yl)methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[2-[(4-methyl-2-pyridyl)methylsulfanyl]ethylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[2-[(4-methyl-2-pyridinyl)methylthio]ethylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(4-methylpyridin-2-yl)methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[2-[(4-methyl-2-pyridyl)methylthio]ethylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)CSCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC(=NC=C1)CSCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

InChI

InChI=1S/C19H21N5OS/c1-14-4-6-21-17(9-14)13-26-8-7-22-19-23-12-16(18(25)24-19)10-15-3-2-5-20-11-15/h2-6,9,11-12H,7-8,10,13H2,1H3,(H2,22,23,24,25)