2-hexylsulfanyl-3-(3-methylphenyl)quinazolin-4-one

Systemtic Name: 2-hexylsulfanyl-3-(3-methylphenyl)quinazolin-4-one Openeye Name: 2-hexylsulfanyl-3-(m-tolyl)quinazolin-4-one CAS Name: 2-(hexylthio)-3-(3-methylphenyl)-4-quinazolinone IUPAC Name: 2-hexylsulfanyl-3-(3-methylphenyl)quinazolin-4-one Traditional Name: 2-(hexylthio)-3-(m-tolyl)quinazolin-4-one Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C

Isomeric SMILES

CCCCCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C

InChI

InChI=1S/C21H24N2OS/c1-3-4-5-8-14-25-21-22-19-13-7-6-12-18(19)20(24)23(21)17-11-9-10-16(2)15-17/h6-7,9-13,15H,3-5,8,14H2,1-2H3