[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: [(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-(thiophen-3-ylmethyl)azanium Openeye Name: [(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-(3-thienylmethyl)ammonium CAS Name: [(1S)-1-(1-ethyl-3-methyl-4-pyrazolyl)ethyl]-(3-thiophenylmethyl)ammonium IUPAC Name: [(1S)-1-(1-ethyl-3-methylpyrazol-4-yl)ethyl]-(thiophen-3-ylmethyl)azanium Traditional Name: [(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-(3-thenyl)ammonium Formula: C13H20N3S+ MolecularWeight: 250.383

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C(C)[NH2+]CC2=CSC=C2

Isomeric SMILES

CCN1C=C(C(=N1)C)[C@H](C)[NH2+]CC2=CSC=C2

InChI

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