3-(4-butylsulfanylphenyl)quinazolin-4-one

Systemtic Name: 3-(4-butylsulfanylphenyl)quinazolin-4-one Openeye Name: 3-(4-butylsulfanylphenyl)quinazolin-4-one CAS Name: 3-[4-(butylthio)phenyl]-4-quinazolinone IUPAC Name: 3-(4-butylsulfanylphenyl)quinazolin-4-one Traditional Name: 3-[4-(butylthio)phenyl]quinazolin-4-one Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCSC1=CC=C(C=C1)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C18H18N2OS/c1-2-3-12-22-15-10-8-14(9-11-15)20-13-19-17-7-5-4-6-16(17)18(20)21/h4-11,13H,2-3,12H2,1H3