2-[(E)-(1-ethyl-2-oxidanylidene-indol-3-ylidene)methyl]-6-iodanyl-3-(4-methylphenyl)quinazolin-4-one

Systemtic Name: 2-[(E)-(1-ethyl-2-oxidanylidene-indol-3-ylidene)methyl]-6-iodanyl-3-(4-methylphenyl)quinazolin-4-one Openeye Name: 2-[(E)-(1-ethyl-2-oxo-indolin-3-ylidene)methyl]-6-iodo-3-(p-tolyl)quinazolin-4-one CAS Name: 2-[(E)-(1-ethyl-2-oxo-3-indolylidene)methyl]-6-iodo-3-(4-methylphenyl)-4-quinazolinone IUPAC Name: 2-[(E)-(1-ethyl-2-oxoindol-3-ylidene)methyl]-6-iodo-3-(4-methylphenyl)quinazolin-4-one Traditional Name: 2-[(E)-(1-ethyl-2-keto-indolin-3-ylidene)methyl]-6-iodo-3-(p-tolyl)quinazolin-4-one Formula: C26H20IN3O2 MolecularWeight: 533.36037

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=CC3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=C(C=C5)C)C1=O

Isomeric SMILES

CCN1C2=CC=CC=C2/C(=C\C3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=C(C=C5)C)/C1=O

InChI

InChI=1S/C26H20IN3O2/c1-3-29-23-7-5-4-6-19(23)20(25(29)31)15-24-28-22-13-10-17(27)14-21(22)26(32)30(24)18-11-8-16(2)9-12-18/h4-15H,3H2,1-2H3/b20-15+