6-iodanyl-2-pentylsulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-2-pentylsulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-iodo-2-pentylsulfanyl-quinazolin-4-one CAS Name: 6-iodo-2-(pentylthio)-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-iodo-2-pentylsulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-(amylthio)-6-iodo-quinazolin-4-one Formula: C16H19IN2OS MolecularWeight: 414.30433

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC=C

Isomeric SMILES

CCCCCSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC=C

InChI

InChI=1S/C16H19IN2OS/c1-3-5-6-10-21-16-18-14-8-7-12(17)11-13(14)15(20)19(16)9-4-2/h4,7-8,11H,2-3,5-6,9-10H2,1H3