3-[(3-chlorophenyl)methyl]-5-[[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]-2-methylsulfanyl-imidazol-4-one

Systemtic Name: 3-[(3-chlorophenyl)methyl]-5-[[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]-2-methylsulfanyl-imidazol-4-one Openeye Name: 3-[(3-chlorophenyl)methyl]-5-[[(4,6-dimethylpyrimidin-2-yl)amino]methylene]-2-methylsulfanyl-imidazol-4-one CAS Name: 3-[(3-chlorophenyl)methyl]-5-[[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene]-2-(methylthio)-4-imidazolone IUPAC Name: 3-[(3-chlorophenyl)methyl]-5-[[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]-2-methylsulfanylimidazol-4-one Traditional Name: 3-(3-chlorobenzyl)-5-[[(4,6-dimethylpyrimidin-2-yl)amino]methylene]-2-(methylthio)-2-imidazolin-4-one Formula: C18H18ClN5OS MolecularWeight: 387.88642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC=C2C(=O)N(C(=N2)SC)CC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC=C2C(=O)N(C(=N2)SC)CC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C18H18ClN5OS/c1-11-7-12(2)22-17(21-11)20-9-15-16(25)24(18(23-15)26-3)10-13-5-4-6-14(19)8-13/h4-9H,10H2,1-3H3,(H,20,21,22)