[(1,5-dimethyl-2-phenyl-3H-pyrazol-4-yl)-methyl-amino]methanesulfinate

Systemtic Name: [(1,5-dimethyl-2-phenyl-3H-pyrazol-4-yl)-methyl-amino]methanesulfinate Openeye Name: [(1,5-dimethyl-2-phenyl-3H-pyrazol-4-yl)-methyl-amino]methanesulfinate CAS Name: [(1,5-dimethyl-2-phenyl-3H-pyrazol-4-yl)-methylamino]methanesulfinate IUPAC Name: [(1,5-dimethyl-2-phenyl-3H-pyrazol-4-yl)-methylamino]methanesulfinate Traditional Name: [(2,3-dimethyl-1-phenyl-3-pyrazolin-4-yl)-methyl-amino]methanesulfinate Formula: C13H18N3O2S- MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CN(N1C)C2=CC=CC=C2)N(C)CS(=O)[O-]

Isomeric SMILES

CC1=C(CN(N1C)C2=CC=CC=C2)N(C)CS(=O)[O-]

InChI

InChI=1S/C13H19N3O2S/c1-11-13(14(2)10-19(17)18)9-16(15(11)3)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3,(H,17,18)/p-1