6-iodanyl-3-(4-methylphenyl)-2-pentylsulfanyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(4-methylphenyl)-2-pentylsulfanyl-quinazolin-4-one Openeye Name: 6-iodo-2-pentylsulfanyl-3-(p-tolyl)quinazolin-4-one CAS Name: 6-iodo-3-(4-methylphenyl)-2-(pentylthio)-4-quinazolinone IUPAC Name: 6-iodo-3-(4-methylphenyl)-2-pentylsulfanylquinazolin-4-one Traditional Name: 2-(amylthio)-6-iodo-3-(p-tolyl)quinazolin-4-one Formula: C20H21IN2OS MolecularWeight: 464.36301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=C(C=C3)C

InChI

InChI=1S/C20H21IN2OS/c1-3-4-5-12-25-20-22-18-11-8-15(21)13-17(18)19(24)23(20)16-9-6-14(2)7-10-16/h6-11,13H,3-5,12H2,1-2H3