3-[(4-methylsulfanylphenyl)methyl]quinazolin-4-one

Systemtic Name: 3-[(4-methylsulfanylphenyl)methyl]quinazolin-4-one Openeye Name: 3-[(4-methylsulfanylphenyl)methyl]quinazolin-4-one CAS Name: 3-[[4-(methylthio)phenyl]methyl]-4-quinazolinone IUPAC Name: 3-[(4-methylsulfanylphenyl)methyl]quinazolin-4-one Traditional Name: 3-[4-(methylthio)benzyl]quinazolin-4-one Formula: C16H14N2OS MolecularWeight: 282.36016

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CSC1=CC=C(C=C1)CN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H14N2OS/c1-20-13-8-6-12(7-9-13)10-18-11-17-15-5-3-2-4-14(15)16(18)19/h2-9,11H,10H2,1H3