N-(4-methylsulfanylphenyl)-7H-purin-6-amine

Systemtic Name: N-(4-methylsulfanylphenyl)-7H-purin-6-amine Openeye Name: N-(4-methylsulfanylphenyl)-7H-purin-6-amine CAS Name: N-[4-(methylthio)phenyl]-7H-purin-6-amine IUPAC Name: N-(4-methylsulfanylphenyl)-7H-purin-6-amine Traditional Name: [4-(methylthio)phenyl]-(7H-purin-6-yl)amine Formula: C12H11N5S MolecularWeight: 257.31424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC2=NC=NC3=C2NC=N3

Isomeric SMILES

CSC1=CC=C(C=C1)NC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C12H11N5S/c1-18-9-4-2-8(3-5-9)17-12-10-11(14-6-13-10)15-7-16-12/h2-7H,1H3,(H2,13,14,15,16,17)