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

Systemtic Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-3-(2-hydroxyethyl)-6-iodanyl-quinazolin-4-one Openeye Name: 2-[(E)-2-(4-dimethylaminophenyl)vinyl]-3-(2-hydroxyethyl)-6-iodo-quinazolin-4-one CAS Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-3-(2-hydroxyethyl)-6-iodo-4-quinazolinone IUPAC Name: 2-[(E)-2-(4-dimethylaminophenyl)ethenyl]-3-(2-hydroxyethyl)-6-iodoquinazolin-4-one Traditional Name: 2-[(E)-2-(4-dimethylaminophenyl)vinyl]-3-(2-hydroxyethyl)-6-iodo-quinazolin-4-one Formula: C20H20IN3O2 MolecularWeight: 461.29617

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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)N2CCO

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C2=NC3=C(C=C(C=C3)I)C(=O)N2CCO

InChI

InChI=1S/C20H20IN3O2/c1-23(2)16-7-3-14(4-8-16)5-10-19-22-18-9-6-15(21)13-17(18)20(26)24(19)11-12-25/h3-10,13,25H,11-12H2,1-2H3/b10-5+