2-hexylsulfanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 2-hexylsulfanyl-3-phenyl-quinazolin-4-one Openeye Name: 2-hexylsulfanyl-3-phenyl-quinazolin-4-one CAS Name: 2-(hexylthio)-3-phenyl-4-quinazolinone IUPAC Name: 2-hexylsulfanyl-3-phenylquinazolin-4-one Traditional Name: 2-(hexylthio)-3-phenyl-quinazolin-4-one Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2OS/c1-2-3-4-10-15-24-20-21-18-14-9-8-13-17(18)19(23)22(20)16-11-6-5-7-12-16/h5-9,11-14H,2-4,10,15H2,1H3