2-[1-(1H-imidazol-2-ylsulfanyl)ethyl]-5-methyl-3-(2-methylphenyl)quinazolin-4-one

Systemtic Name: 2-[1-(1H-imidazol-2-ylsulfanyl)ethyl]-5-methyl-3-(2-methylphenyl)quinazolin-4-one Openeye Name: 2-[1-(1H-imidazol-2-ylsulfanyl)ethyl]-5-methyl-3-(o-tolyl)quinazolin-4-one CAS Name: 2-[1-(1H-imidazol-2-ylthio)ethyl]-5-methyl-3-(2-methylphenyl)-4-quinazolinone IUPAC Name: 2-[1-(1H-imidazol-2-ylsulfanyl)ethyl]-5-methyl-3-(2-methylphenyl)quinazolin-4-one Traditional Name: 2-[1-(1H-imidazol-2-ylthio)ethyl]-5-methyl-3-(o-tolyl)quinazolin-4-one Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)C(C)SC4=NC=CN4

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)C(C)SC4=NC=CN4

InChI

InChI=1S/C21H20N4OS/c1-13-7-4-5-10-17(13)25-19(15(3)27-21-22-11-12-23-21)24-16-9-6-8-14(2)18(16)20(25)26/h4-12,15H,1-3H3,(H,22,23)