2-(2-dimethylaminoethylsulfanyl)-9-(phenylmethyl)purin-6-amine

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-9-(phenylmethyl)purin-6-amine Openeye Name: 9-benzyl-2-(2-dimethylaminoethylsulfanyl)purin-6-amine CAS Name: 2-(2-dimethylaminoethylthio)-9-(phenylmethyl)-6-purinamine IUPAC Name: 9-benzyl-2-(2-dimethylaminoethylsulfanyl)purin-6-amine Traditional Name: 2-[(6-amino-9-benzyl-purin-2-yl)thio]ethyl-dimethyl-amine Formula: C16H20N6S MolecularWeight: 328.4352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CN(C)CCSC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C16H20N6S/c1-21(2)8-9-23-16-19-14(17)13-15(20-16)22(11-18-13)10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H2,17,19,20)