9-butyl-N-phenyl-6-(thiophen-2-ylmethoxy)purin-2-amine

Systemtic Name: 9-butyl-N-phenyl-6-(thiophen-2-ylmethoxy)purin-2-amine Openeye Name: 9-butyl-N-phenyl-6-(2-thienylmethoxy)purin-2-amine CAS Name: 9-butyl-N-phenyl-6-(thiophen-2-ylmethoxy)-2-purinamine IUPAC Name: 9-butyl-N-phenyl-6-(thiophen-2-ylmethoxy)purin-2-amine Traditional Name: [9-butyl-6-(2-thenyloxy)purin-2-yl]-phenyl-amine Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2OCC3=CC=CS3)NC4=CC=CC=C4

Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2OCC3=CC=CS3)NC4=CC=CC=C4

InChI

InChI=1S/C20H21N5OS/c1-2-3-11-25-14-21-17-18(25)23-20(22-15-8-5-4-6-9-15)24-19(17)26-13-16-10-7-12-27-16/h4-10,12,14H,2-3,11,13H2,1H3,(H,22,23,24)