(1-ethyl-3-methyl-pyrazol-4-yl)methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: (1-ethyl-3-methyl-pyrazol-4-yl)methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: (1-ethyl-3-methyl-pyrazol-4-yl)methyl-(2-hydroxyethyl)-(2-thienylmethyl)ammonium CAS Name: (1-ethyl-3-methyl-4-pyrazolyl)methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: (1-ethyl-3-methylpyrazol-4-yl)methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: (1-ethyl-3-methyl-pyrazol-4-yl)methyl-(2-hydroxyethyl)-(2-thenyl)ammonium Formula: C14H22N3OS+ MolecularWeight: 280.40898

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C[NH+](CCO)CC2=CC=CS2

Isomeric SMILES

CCN1C=C(C(=N1)C)C[NH+](CCO)CC2=CC=CS2

InChI

InChI=1S/C14H21N3OS/c1-3-17-10-13(12(2)15-17)9-16(6-7-18)11-14-5-4-8-19-14/h4-5,8,10,18H,3,6-7,9,11H2,1-2H3/p+1