N-[(4-methylsulfonylphenyl)methyl]-7H-purin-6-amine

Systemtic Name: N-[(4-methylsulfonylphenyl)methyl]-7H-purin-6-amine Openeye Name: N-[(4-methylsulfonylphenyl)methyl]-7H-purin-6-amine CAS Name: N-[(4-methylsulfonylphenyl)methyl]-7H-purin-6-amine IUPAC Name: N-[(4-methylsulfonylphenyl)methyl]-7H-purin-6-amine Traditional Name: (4-mesylbenzyl)-(7H-purin-6-yl)amine Formula: C13H13N5O2S MolecularWeight: 303.33962

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C13H13N5O2S/c1-21(19,20)10-4-2-9(3-5-10)6-14-12-11-13(16-7-15-11)18-8-17-12/h2-5,7-8H,6H2,1H3,(H2,14,15,16,17,18)