N-(4-bromophenyl)-2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-bromophenyl)acetamide CAS Name: N-(4-bromophenyl)-2-[[6-iodo-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N-(4-bromophenyl)acetamide Traditional Name: 2-[(3-benzyl-6-iodo-4-keto-quinazolin-2-yl)thio]-N-(4-bromophenyl)acetamide Formula: C23H17BrIN3O2S MolecularWeight: 606.27345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H17BrIN3O2S/c24-16-6-9-18(10-7-16)26-21(29)14-31-23-27-20-11-8-17(25)12-19(20)22(30)28(23)13-15-4-2-1-3-5-15/h1-12H,13-14H2,(H,26,29)