6-iodanyl-2-methylsulfanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 6-iodanyl-2-methylsulfanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-6-iodo-2-methylsulfanyl-quinazolin-4-one CAS Name: 6-iodo-2-(methylthio)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-6-iodo-2-methylsulfanylquinazolin-4-one Traditional Name: 3-benzyl-6-iodo-2-(methylthio)quinazolin-4-one Formula: C16H13IN2OS MolecularWeight: 408.25669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C16H13IN2OS/c1-21-16-18-14-8-7-12(17)9-13(14)15(20)19(16)10-11-5-3-2-4-6-11/h2-9H,10H2,1H3