N1-(4-chlorophenyl)-5-iodanyl-4-(pyridin-4-ylmethyl)phthalazine-1,7-diamine

Systemtic Name: N1-(4-chlorophenyl)-5-iodanyl-4-(pyridin-4-ylmethyl)phthalazine-1,7-diamine Openeye Name: N1-(4-chlorophenyl)-5-iodo-4-(4-pyridylmethyl)phthalazine-1,7-diamine CAS Name: N1-(4-chlorophenyl)-5-iodo-4-(pyridin-4-ylmethyl)phthalazine-1,7-diamine IUPAC Name: 1-N-(4-chlorophenyl)-5-iodo-4-(pyridin-4-ylmethyl)phthalazine-1,7-diamine Traditional Name: [7-amino-5-iodo-4-(4-pyridylmethyl)phthalazin-1-yl]-(4-chlorophenyl)amine Formula: C20H15ClIN5 MolecularWeight: 487.72407

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NN=C(C3=C(C=C(C=C32)N)I)CC4=CC=NC=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1NC2=NN=C(C3=C(C=C(C=C32)N)I)CC4=CC=NC=C4)Cl

InChI

InChI=1S/C20H15ClIN5/c21-13-1-3-15(4-2-13)25-20-16-10-14(23)11-17(22)19(16)18(26-27-20)9-12-5-7-24-8-6-12/h1-8,10-11H,9,23H2,(H,25,27)