3-(2,4-dimethylphenyl)-6-iodanyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]quinazolin-4-one

Systemtic Name: 3-(2,4-dimethylphenyl)-6-iodanyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]quinazolin-4-one Openeye Name: 3-(2,4-dimethylphenyl)-6-iodo-2-[(E)-2-(4-methoxyphenyl)vinyl]quinazolin-4-one CAS Name: 3-(2,4-dimethylphenyl)-6-iodo-2-[(E)-2-(4-methoxyphenyl)ethenyl]-4-quinazolinone IUPAC Name: 3-(2,4-dimethylphenyl)-6-iodo-2-[(E)-2-(4-methoxyphenyl)ethenyl]quinazolin-4-one Traditional Name: 3-(2,4-dimethylphenyl)-6-iodo-2-[(E)-2-(4-methoxyphenyl)vinyl]quinazolin-4-one Formula: C25H21IN2O2 MolecularWeight: 508.35091

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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=CC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C25H21IN2O2/c1-16-4-12-23(17(2)14-16)28-24(13-7-18-5-9-20(30-3)10-6-18)27-22-11-8-19(26)15-21(22)25(28)29/h4-15H,1-3H3/b13-7+