6-iodanyl-4-[4-(phenylmethyl)piperazin-1-yl]quinazoline chloride

Systemtic Name: 6-iodanyl-4-[4-(phenylmethyl)piperazin-1-yl]quinazoline chloride Openeye Name: 4-(4-benzylpiperazin-1-yl)-6-iodo-quinazoline chloride CAS Name: 6-iodo-4-[4-(phenylmethyl)-1-piperazinyl]quinazoline chloride IUPAC Name: 4-(4-benzylpiperazin-1-yl)-6-iodoquinazoline chloride Traditional Name: 4-(4-benzylpiperazino)-6-iodo-quinazoline chloride Formula: C19H19ClIN4- MolecularWeight: 465.73843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC=NC4=C3C=C(C=C4)I.[Cl-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC=NC4=C3C=C(C=C4)I.[Cl-]

InChI

InChI=1S/C19H19IN4.ClH/c20-16-6-7-18-17(12-16)19(22-14-21-18)24-10-8-23(9-11-24)13-15-4-2-1-3-5-15;/h1-7,12,14H,8-11,13H2;1H/p-1