2-(1,3-benzodioxol-5-yl)-6-iodanyl-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-6-iodanyl-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-6-iodo-3-(p-tolyl)-1,2-dihydroquinazolin-4-one CAS Name: 2-(1,3-benzodioxol-5-yl)-6-iodo-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 2-(1,3-benzodioxol-5-yl)-6-iodo-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-6-iodo-3-(p-tolyl)-1,2-dihydroquinazolin-4-one Formula: C22H17IN2O3 MolecularWeight: 484.28645

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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)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(NC3=C(C2=O)C=C(C=C3)I)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17IN2O3/c1-13-2-6-16(7-3-13)25-21(14-4-9-19-20(10-14)28-12-27-19)24-18-8-5-15(23)11-17(18)22(25)26/h2-11,21,24H,12H2,1H3