2-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl]ethylazanium

Systemtic Name: 2-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl]ethylazanium Openeye Name: 2-[3,5-dimethyl-1-(p-tolylsulfonyl)pyrazol-4-yl]ethylammonium CAS Name: 2-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-4-pyrazolyl]ethylammonium IUPAC Name: 2-[3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazol-4-yl]ethylazanium Traditional Name: 2-(3,5-dimethyl-1-tosyl-pyrazol-4-yl)ethylammonium Formula: C14H20N3O2S+ MolecularWeight: 294.3925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)CC[NH3+])C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)CC[NH3+])C

InChI

InChI=1S/C14H19N3O2S/c1-10-4-6-13(7-5-10)20(18,19)17-12(3)14(8-9-15)11(2)16-17/h4-7H,8-9,15H2,1-3H3/p+1