N-[(2-bromanylthiophen-3-yl)methyl]-2-chloranyl-9-propan-2-yl-purin-6-amine

Systemtic Name: N-[(2-bromanylthiophen-3-yl)methyl]-2-chloranyl-9-propan-2-yl-purin-6-amine Openeye Name: N-[(2-bromo-3-thienyl)methyl]-2-chloro-9-isopropyl-purin-6-amine CAS Name: N-[(2-bromo-3-thiophenyl)methyl]-2-chloro-9-propan-2-yl-6-purinamine IUPAC Name: N-[(2-bromothiophen-3-yl)methyl]-2-chloro-9-propan-2-ylpurin-6-amine Traditional Name: (2-bromo-3-thienyl)methyl-(2-chloro-9-isopropyl-purin-6-yl)amine Formula: C13H13BrClN5S MolecularWeight: 386.69782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=C(SC=C3)Br)Cl

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=C(SC=C3)Br)Cl

InChI

InChI=1S/C13H13BrClN5S/c1-7(2)20-6-17-9-11(18-13(15)19-12(9)20)16-5-8-3-4-21-10(8)14/h3-4,6-7H,5H2,1-2H3,(H,16,18,19)