6-iodanyl-2-pentylsulfanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-2-pentylsulfanyl-3-phenyl-quinazolin-4-one Openeye Name: 6-iodo-2-pentylsulfanyl-3-phenyl-quinazolin-4-one CAS Name: 6-iodo-2-(pentylthio)-3-phenyl-4-quinazolinone IUPAC Name: 6-iodo-2-pentylsulfanyl-3-phenylquinazolin-4-one Traditional Name: 2-(amylthio)-6-iodo-3-phenyl-quinazolin-4-one Formula: C19H19IN2OS MolecularWeight: 450.33643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19IN2OS/c1-2-3-7-12-24-19-21-17-11-10-14(20)13-16(17)18(23)22(19)15-8-5-4-6-9-15/h4-6,8-11,13H,2-3,7,12H2,1H3