3-[4-(4-methylphenyl)sulfanylbutyl]quinazolin-4-one

Systemtic Name: 3-[4-(4-methylphenyl)sulfanylbutyl]quinazolin-4-one Openeye Name: 3-[4-(p-tolylsulfanyl)butyl]quinazolin-4-one CAS Name: 3-[4-[(4-methylphenyl)thio]butyl]-4-quinazolinone IUPAC Name: 3-[4-(4-methylphenyl)sulfanylbutyl]quinazolin-4-one Traditional Name: 3-[4-(p-tolylthio)butyl]quinazolin-4-one Formula: C19H20N2OS MolecularWeight: 324.4399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H20N2OS/c1-15-8-10-16(11-9-15)23-13-5-4-12-21-14-20-18-7-3-2-6-17(18)19(21)22/h2-3,6-11,14H,4-5,12-13H2,1H3