2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-6-iodanyl-3-(4-methylphenyl)quinazolin-4-one

Systemtic Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-6-iodanyl-3-(4-methylphenyl)quinazolin-4-one Openeye Name: 2-[(E)-2-(4-dimethylaminophenyl)vinyl]-6-iodo-3-(p-tolyl)quinazolin-4-one CAS Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-6-iodo-3-(4-methylphenyl)-4-quinazolinone IUPAC Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-6-iodo-3-(4-methylphenyl)quinazolin-4-one Traditional Name: 2-[(E)-2-(4-dimethylaminophenyl)vinyl]-6-iodo-3-(p-tolyl)quinazolin-4-one Formula: C25H22IN3O MolecularWeight: 507.36615

Click to see the large picture

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)N(C)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)N(C)C

InChI

InChI=1S/C25H22IN3O/c1-17-4-10-21(11-5-17)29-24(15-8-18-6-12-20(13-7-18)28(2)3)27-23-14-9-19(26)16-22(23)25(29)30/h4-16H,1-3H3/b15-8+