(2E)-6-iodanyl-2-[(5-methyl-2-oxidanylidene-indol-3-yl)methylidene]-3-phenethyl-1H-quinazolin-4-one

Systemtic Name: (2E)-6-iodanyl-2-[(5-methyl-2-oxidanylidene-indol-3-yl)methylidene]-3-phenethyl-1H-quinazolin-4-one Openeye Name: (2E)-6-iodo-2-[(5-methyl-2-oxo-indol-3-yl)methylene]-3-phenethyl-1H-quinazolin-4-one CAS Name: (2E)-6-iodo-2-[(5-methyl-2-oxo-3-indolyl)methylidene]-3-phenethyl-1H-quinazolin-4-one IUPAC Name: (2E)-6-iodo-2-[(5-methyl-2-oxoindol-3-yl)methylidene]-3-phenethyl-1H-quinazolin-4-one Traditional Name: (2E)-6-iodo-2-[(2-keto-5-methyl-indol-3-yl)methylene]-3-phenethyl-1H-quinazolin-4-one Formula: C26H20IN3O2 MolecularWeight: 533.36037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=O)N=C2C=C1)C=C3NC4=C(C=C(C=C4)I)C(=O)N3CCC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C(=O)N=C2C=C1)/C=C/3\NC4=C(C=C(C=C4)I)C(=O)N3CCC5=CC=CC=C5

InChI

InChI=1S/C26H20IN3O2/c1-16-7-9-22-19(13-16)20(25(31)29-22)15-24-28-23-10-8-18(27)14-21(23)26(32)30(24)12-11-17-5-3-2-4-6-17/h2-10,13-15,28H,11-12H2,1H3/b24-15+