2-[(E)-2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 2-[(E)-2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodanyl-3-phenyl-quinazolin-4-one Openeye Name: 2-[(E)-2-(1,2-dimethylindol-3-yl)vinyl]-6-iodo-3-phenyl-quinazolin-4-one CAS Name: 2-[(E)-2-(1,2-dimethyl-3-indolyl)ethenyl]-6-iodo-3-phenyl-4-quinazolinone IUPAC Name: 2-[(E)-2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-3-phenylquinazolin-4-one Traditional Name: 2-[(E)-2-(1,2-dimethylindol-3-yl)vinyl]-6-iodo-3-phenyl-quinazolin-4-one Formula: C26H20IN3O MolecularWeight: 517.36097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C=CC3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)/C=C/C3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C26H20IN3O/c1-17-20(21-10-6-7-11-24(21)29(17)2)13-15-25-28-23-14-12-18(27)16-22(23)26(31)30(25)19-8-4-3-5-9-19/h3-16H,1-2H3/b15-13+