2-[2-[(2-chlorophenyl)methylsulfanyl]ethylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]ethylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]ethylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[2-[(2-chlorophenyl)methylthio]ethylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]ethylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[2-[(2-chlorobenzyl)thio]ethylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C20H21ClN4OS MolecularWeight: 400.92494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCSCC3=CC=CC=C3Cl

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCSCC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4OS/c1-14-6-7-15(11-23-14)10-17-12-24-20(25-19(17)26)22-8-9-27-13-16-4-2-3-5-18(16)21/h2-7,11-12H,8-10,13H2,1H3,(H2,22,24,25,26)