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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C25H22IN3O/c1-28(2)21-12-8-18(9-13-21)10-15-24-27-23-14-11-20(26)16-22(23)25(30)29(24)17-19-6-4-3-5-7-19/h3-16H,17H2,1-2H3/b15-10+