[(1S)-1-(1-adamantyl)ethyl]-[(4-bromanylthiophen-2-yl)methyl]azanium

Systemtic Name: [(1S)-1-(1-adamantyl)ethyl]-[(4-bromanylthiophen-2-yl)methyl]azanium Openeye Name: [(1S)-1-(1-adamantyl)ethyl]-[(4-bromo-2-thienyl)methyl]ammonium CAS Name: [(1S)-1-(1-adamantyl)ethyl]-[(4-bromo-2-thiophenyl)methyl]ammonium IUPAC Name: [(1S)-1-(1-adamantyl)ethyl]-[(4-bromothiophen-2-yl)methyl]azanium Traditional Name: [(1S)-1-(1-adamantyl)ethyl]-[(4-bromo-2-thienyl)methyl]ammonium Formula: C17H25BrNS+ MolecularWeight: 355.3561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)[NH2+]CC4=CC(=CS4)Br

Isomeric SMILES

C[C@@H](C12CC3CC(C1)CC(C3)C2)[NH2+]CC4=CC(=CS4)Br

InChI

InChI=1S/C17H24BrNS/c1-11(19-9-16-5-15(18)10-20-16)17-6-12-2-13(7-17)4-14(3-12)8-17/h5,10-14,19H,2-4,6-9H2,1H3/p+1/t11-,12?,13?,14?,17?/m0/s1