(4-bromanylthiophen-2-yl)methyl-[(1S)-1-pyridin-3-ylethyl]azanium

Systemtic Name: (4-bromanylthiophen-2-yl)methyl-[(1S)-1-pyridin-3-ylethyl]azanium Openeye Name: (4-bromo-2-thienyl)methyl-[(1S)-1-(3-pyridyl)ethyl]ammonium CAS Name: (4-bromo-2-thiophenyl)methyl-[(1S)-1-(3-pyridinyl)ethyl]ammonium IUPAC Name: (4-bromothiophen-2-yl)methyl-[(1S)-1-pyridin-3-ylethyl]azanium Traditional Name: (4-bromo-2-thienyl)methyl-[(1S)-1-(3-pyridyl)ethyl]ammonium Formula: C12H14BrN2S+ MolecularWeight: 298.22196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)[NH2+]CC2=CC(=CS2)Br

Isomeric SMILES

C[C@@H](C1=CN=CC=C1)[NH2+]CC2=CC(=CS2)Br

InChI

InChI=1S/C12H13BrN2S/c1-9(10-3-2-4-14-6-10)15-7-12-5-11(13)8-16-12/h2-6,8-9,15H,7H2,1H3/p+1/t9-/m0/s1