8-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-7H-purin-6-amine

Systemtic Name: 8-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-7H-purin-6-amine Openeye Name: 8-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-7H-purin-6-amine CAS Name: 8-[2-(3,4-dimethylphenoxy)ethylthio]-7H-purin-6-amine IUPAC Name: 8-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-7H-purin-6-amine Traditional Name: [8-[2-(3,4-dimethylphenoxy)ethylthio]-7H-purin-6-yl]amine Formula: C15H17N5OS MolecularWeight: 315.39338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCSC2=NC3=C(N2)C(=NC=N3)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCSC2=NC3=C(N2)C(=NC=N3)N)C

InChI

InChI=1S/C15H17N5OS/c1-9-3-4-11(7-10(9)2)21-5-6-22-15-19-12-13(16)17-8-18-14(12)20-15/h3-4,7-8H,5-6H2,1-2H3,(H3,16,17,18,19,20)