1-(1-adamantyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-(1-adamantyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-(1-adamantyl)-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-(1-adamantyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-(1-adamantyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-(1-adamantyl)-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C18H27N2O2S2+ MolecularWeight: 367.54918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CC[NH+]1C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C18H26N2O2S2/c21-24(22,17-2-1-7-23-17)20-5-3-19(4-6-20)18-11-14-8-15(12-18)10-16(9-14)13-18/h1-2,7,14-16H,3-6,8-13H2/p+1