6-[4-(4-thiophen-2-ylphenyl)sulfonylpiperidin-1-yl]-7H-purine

Systemtic Name: 6-[4-(4-thiophen-2-ylphenyl)sulfonylpiperidin-1-yl]-7H-purine Openeye Name: 6-[4-[4-(2-thienyl)phenyl]sulfonyl-1-piperidyl]-7H-purine CAS Name: 6-[4-(4-thiophen-2-ylphenyl)sulfonyl-1-piperidinyl]-7H-purine IUPAC Name: 6-[4-(4-thiophen-2-ylphenyl)sulfonylpiperidin-1-yl]-7H-purine Traditional Name: 6-[4-[4-(2-thienyl)phenyl]sulfonylpiperidino]-7H-purine Formula: C20H19N5O2S2 MolecularWeight: 425.52716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CC=CS3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CC=CS3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C20H19N5O2S2/c26-29(27,15-5-3-14(4-6-15)17-2-1-11-28-17)16-7-9-25(10-8-16)20-18-19(22-12-21-18)23-13-24-20/h1-6,11-13,16H,7-10H2,(H,21,22,23,24)