[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-(2-thienylmethyl)ammonium CAS Name: [(1S)-1-(1,3-dimethyl-4-pyrazolyl)ethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-(2-thenyl)ammonium Formula: C12H18N3S+ MolecularWeight: 236.35642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(C)[NH2+]CC2=CC=CS2)C

Isomeric SMILES

CC1=NN(C=C1[C@H](C)[NH2+]CC2=CC=CS2)C

InChI

InChI=1S/C12H17N3S/c1-9(12-8-15(3)14-10(12)2)13-7-11-5-4-6-16-11/h4-6,8-9,13H,7H2,1-3H3/p+1/t9-/m0/s1