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

Systemtic Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[(3-methylphenyl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-(m-tolylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-5-[(3-methylphenyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-5-[(3-methylphenyl)methyl]-1H-pyrimidin-6-one Traditional Name: 5-(3-methylbenzyl)-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-1H-pyrimidin-6-one Formula: C19H23N5OS MolecularWeight: 369.48382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=CN=C(NC2=O)NCCSCC3=C(NC=N3)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=CN=C(NC2=O)NCCSCC3=C(NC=N3)C

InChI

InChI=1S/C19H23N5OS/c1-13-4-3-5-15(8-13)9-16-10-21-19(24-18(16)25)20-6-7-26-11-17-14(2)22-12-23-17/h3-5,8,10,12H,6-7,9,11H2,1-2H3,(H,22,23)(H2,20,21,24,25)