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

Systemtic Name: 6-iodanyl-2-[(Z)-(1-methyl-2-oxidanylidene-indol-3-ylidene)methyl]-3-(4-methylphenyl)quinazolin-4-one Openeye Name: 6-iodo-2-[(Z)-(1-methyl-2-oxo-indolin-3-ylidene)methyl]-3-(p-tolyl)quinazolin-4-one CAS Name: 6-iodo-2-[(Z)-(1-methyl-2-oxo-3-indolylidene)methyl]-3-(4-methylphenyl)-4-quinazolinone IUPAC Name: 6-iodo-2-[(Z)-(1-methyl-2-oxoindol-3-ylidene)methyl]-3-(4-methylphenyl)quinazolin-4-one Traditional Name: 6-iodo-2-[(Z)-(2-keto-1-methyl-indolin-3-ylidene)methyl]-3-(p-tolyl)quinazolin-4-one Formula: C25H18IN3O2 MolecularWeight: 519.33379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=C4C5=CC=CC=C5N(C4=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C\4/C5=CC=CC=C5N(C4=O)C

InChI

InChI=1S/C25H18IN3O2/c1-15-7-10-17(11-8-15)29-23(27-21-12-9-16(26)13-20(21)25(29)31)14-19-18-5-3-4-6-22(18)28(2)24(19)30/h3-14H,1-2H3/b19-14-