N-[(2S)-2-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-6-iodanyl-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]-2-ethoxy-benzamide

Systemtic Name: N-[(2S)-2-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-6-iodanyl-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]-2-ethoxy-benzamide Openeye Name: N-[(2S)-2-(3,5-dibromo-2-hydroxy-phenyl)-6-iodo-4-oxo-1,2-dihydroquinazolin-3-yl]-2-ethoxy-benzamide CAS Name: N-[(2S)-2-(3,5-dibromo-2-hydroxyphenyl)-6-iodo-4-oxo-1,2-dihydroquinazolin-3-yl]-2-ethoxybenzamide IUPAC Name: N-[(2S)-2-(3,5-dibromo-2-hydroxyphenyl)-6-iodo-4-oxo-1,2-dihydroquinazolin-3-yl]-2-ethoxybenzamide Traditional Name: N-[(2S)-2-(3,5-dibromo-2-hydroxy-phenyl)-6-iodo-4-keto-1,2-dihydroquinazolin-3-yl]-2-ethoxy-benzamide Formula: C23H18Br2IN3O4 MolecularWeight: 687.11919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NN2C(NC3=C(C2=O)C=C(C=C3)I)C4=CC(=CC(=C4O)Br)Br

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NN2[C@H](NC3=C(C2=O)C=C(C=C3)I)C4=CC(=CC(=C4O)Br)Br

InChI

InChI=1S/C23H18Br2IN3O4/c1-2-33-19-6-4-3-5-14(19)22(31)28-29-21(16-9-12(24)10-17(25)20(16)30)27-18-8-7-13(26)11-15(18)23(29)32/h3-11,21,27,30H,2H2,1H3,(H,28,31)/t21-/m0/s1