N-(3-chlorophenyl)-2-iodanyl-9-propan-2-yl-purin-6-amine

Systemtic Name: N-(3-chlorophenyl)-2-iodanyl-9-propan-2-yl-purin-6-amine Openeye Name: N-(3-chlorophenyl)-2-iodo-9-isopropyl-purin-6-amine CAS Name: N-(3-chlorophenyl)-2-iodo-9-propan-2-yl-6-purinamine IUPAC Name: N-(3-chlorophenyl)-2-iodo-9-propan-2-ylpurin-6-amine Traditional Name: (3-chlorophenyl)-(2-iodo-9-isopropyl-purin-6-yl)amine Formula: C14H13ClIN5 MolecularWeight: 413.64399

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)I

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)I

InChI

InChI=1S/C14H13ClIN5/c1-8(2)21-7-17-11-12(19-14(16)20-13(11)21)18-10-5-3-4-9(15)6-10/h3-8H,1-2H3,(H,18,19,20)