N-[(1-phenethylsulfonylpiperidin-4-yl)methyl]-7H-purin-2-amine

Systemtic Name: N-[(1-phenethylsulfonylpiperidin-4-yl)methyl]-7H-purin-2-amine Openeye Name: N-[(1-phenethylsulfonyl-4-piperidyl)methyl]-7H-purin-2-amine CAS Name: N-[(1-phenethylsulfonyl-4-piperidinyl)methyl]-7H-purin-2-amine IUPAC Name: N-[(1-phenethylsulfonylpiperidin-4-yl)methyl]-7H-purin-2-amine Traditional Name: (1-phenethylsulfonyl-4-piperidyl)methyl-(7H-purin-2-yl)amine Formula: C19H24N6O2S MolecularWeight: 400.49786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC=C3C(=N2)N=CN3)S(=O)(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CNC2=NC=C3C(=N2)N=CN3)S(=O)(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C19H24N6O2S/c26-28(27,11-8-15-4-2-1-3-5-15)25-9-6-16(7-10-25)12-20-19-21-13-17-18(24-19)23-14-22-17/h1-5,13-14,16H,6-12H2,(H2,20,21,22,23,24)