5-chloranyl-3-[(3-iodanylphenyl)methyl]-1-(phenylmethyl)-7-piperazin-1-yl-quinazoline-2,4-dione

Systemtic Name: 5-chloranyl-3-[(3-iodanylphenyl)methyl]-1-(phenylmethyl)-7-piperazin-1-yl-quinazoline-2,4-dione Openeye Name: 1-benzyl-5-chloro-3-[(3-iodophenyl)methyl]-7-piperazin-1-yl-quinazoline-2,4-dione CAS Name: 5-chloro-3-[(3-iodophenyl)methyl]-1-(phenylmethyl)-7-(1-piperazinyl)quinazoline-2,4-dione IUPAC Name: 1-benzyl-5-chloro-3-[(3-iodophenyl)methyl]-7-piperazin-1-ylquinazoline-2,4-dione Traditional Name: 1-benzyl-5-chloro-3-(3-iodobenzyl)-7-piperazino-quinazoline-2,4-quinone Formula: C26H24ClIN4O2 MolecularWeight: 586.85183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=C3C(=C2)N(C(=O)N(C3=O)CC4=CC(=CC=C4)I)CC5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1)C2=CC(=C3C(=C2)N(C(=O)N(C3=O)CC4=CC(=CC=C4)I)CC5=CC=CC=C5)Cl

InChI

InChI=1S/C26H24ClIN4O2/c27-22-14-21(30-11-9-29-10-12-30)15-23-24(22)25(33)32(17-19-7-4-8-20(28)13-19)26(34)31(23)16-18-5-2-1-3-6-18/h1-8,13-15,29H,9-12,16-17H2