[(1S)-1-thiophen-2-ylethyl]-[(1,3,5-trimethylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(1S)-1-thiophen-2-ylethyl]-[(1,3,5-trimethylpyrazol-4-yl)methyl]azanium Openeye Name: [(1S)-1-(2-thienyl)ethyl]-[(1,3,5-trimethylpyrazol-4-yl)methyl]ammonium CAS Name: [(1S)-1-thiophen-2-ylethyl]-[(1,3,5-trimethyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(1S)-1-thiophen-2-ylethyl]-[(1,3,5-trimethylpyrazol-4-yl)methyl]azanium Traditional Name: [(1S)-1-(2-thienyl)ethyl]-[(1,3,5-trimethylpyrazol-4-yl)methyl]ammonium Formula: C13H20N3S+ MolecularWeight: 250.383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C[NH2+]C(C)C2=CC=CS2

Isomeric SMILES

CC1=C(C(=NN1C)C)C[NH2+][C@@H](C)C2=CC=CS2

InChI

InChI=1S/C13H19N3S/c1-9-12(11(3)16(4)15-9)8-14-10(2)13-6-5-7-17-13/h5-7,10,14H,8H2,1-4H3/p+1/t10-/m0/s1