6-iodanyl-3-phenyl-2-[(2-phenylquinazolin-4-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-phenyl-2-[(2-phenylquinazolin-4-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 6-iodo-3-phenyl-2-[(2-phenylquinazolin-4-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 6-iodo-3-phenyl-2-[[(2-phenyl-4-quinazolinyl)thio]methyl]-4-quinazolinone IUPAC Name: 6-iodo-3-phenyl-2-[(2-phenylquinazolin-4-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 6-iodo-3-phenyl-2-[[(2-phenylquinazolin-4-yl)thio]methyl]quinazolin-4-one Formula: C29H19IN4OS MolecularWeight: 598.45683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)SCC4=NC5=C(C=C(C=C5)I)C(=O)N4C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)SCC4=NC5=C(C=C(C=C5)I)C(=O)N4C6=CC=CC=C6

InChI

InChI=1S/C29H19IN4OS/c30-20-15-16-25-23(17-20)29(35)34(21-11-5-2-6-12-21)26(31-25)18-36-28-22-13-7-8-14-24(22)32-27(33-28)19-9-3-1-4-10-19/h1-17H,18H2