(5-chloranylthiophen-2-yl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium Openeye Name: (5-chloro-2-thienyl)methyl-[(1S)-1-(4-pyridyl)ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[(1S)-1-pyridin-4-ylethyl]ammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium Traditional Name: (5-chloro-2-thienyl)methyl-[(1S)-1-(4-pyridyl)ethyl]ammonium Formula: C12H14ClN2S+ MolecularWeight: 253.77096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)[NH2+]CC2=CC=C(S2)Cl

Isomeric SMILES

C[C@@H](C1=CC=NC=C1)[NH2+]CC2=CC=C(S2)Cl

InChI

InChI=1S/C12H13ClN2S/c1-9(10-4-6-14-7-5-10)15-8-11-2-3-12(13)16-11/h2-7,9,15H,8H2,1H3/p+1/t9-/m0/s1