(1-tert-butyl-3-thiophen-2-yl-pyrazol-4-yl)methyl-methyl-azanium

Systemtic Name: (1-tert-butyl-3-thiophen-2-yl-pyrazol-4-yl)methyl-methyl-azanium Openeye Name: [1-tert-butyl-3-(2-thienyl)pyrazol-4-yl]methyl-methyl-ammonium CAS Name: (1-tert-butyl-3-thiophen-2-yl-4-pyrazolyl)methyl-methylammonium IUPAC Name: (1-tert-butyl-3-thiophen-2-ylpyrazol-4-yl)methyl-methylazanium Traditional Name: [1-tert-butyl-3-(2-thienyl)pyrazol-4-yl]methyl-methyl-ammonium Formula: C13H20N3S+ MolecularWeight: 250.383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=N1)C2=CC=CS2)C[NH2+]C

Isomeric SMILES

CC(C)(C)N1C=C(C(=N1)C2=CC=CS2)C[NH2+]C

InChI

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