6-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-7H-purine

Systemtic Name: 6-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-7H-purine Openeye Name: 6-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-7H-purine CAS Name: 6-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-7H-purine IUPAC Name: 6-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-7H-purine Traditional Name: 6-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-7H-purine Formula: C13H13BrN6O2S2 MolecularWeight: 429.31532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2NC=N3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2NC=N3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C13H13BrN6O2S2/c14-9-1-2-10(23-9)24(21,22)20-5-3-19(4-6-20)13-11-12(16-7-15-11)17-8-18-13/h1-2,7-8H,3-6H2,(H,15,16,17,18)