N-(1H-benzimidazol-2-yl)-2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1H-benzimidazol-2-yl)-2-(3-benzyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(1H-benzimidazol-2-yl)-2-[[6-iodo-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(1H-benzimidazol-2-yl)-2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1H-benzimidazol-2-yl)-2-[(3-benzyl-6-iodo-4-keto-quinazolin-2-yl)thio]acetamide Formula: C24H18IN5O2S MolecularWeight: 567.40149

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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=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)NC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C24H18IN5O2S/c25-16-10-11-18-17(12-16)22(32)30(13-15-6-2-1-3-7-15)24(28-18)33-14-21(31)29-23-26-19-8-4-5-9-20(19)27-23/h1-12H,13-14H2,(H2,26,27,29,31)