6-[(2,4,6-trimethylphenyl)methylsulfanyl]-7H-purine

Systemtic Name: 6-[(2,4,6-trimethylphenyl)methylsulfanyl]-7H-purine Openeye Name: 6-[(2,4,6-trimethylphenyl)methylsulfanyl]-7H-purine CAS Name: 6-[(2,4,6-trimethylphenyl)methylthio]-7H-purine IUPAC Name: 6-[(2,4,6-trimethylphenyl)methylsulfanyl]-7H-purine Traditional Name: 6-[(2,4,6-trimethylbenzyl)thio]-7H-purine Formula: C15H16N4S MolecularWeight: 284.37934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CSC2=NC=NC3=C2NC=N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CSC2=NC=NC3=C2NC=N3)C

InChI

InChI=1S/C15H16N4S/c1-9-4-10(2)12(11(3)5-9)6-20-15-13-14(17-7-16-13)18-8-19-15/h4-5,7-8H,6H2,1-3H3,(H,16,17,18,19)