1,3,5-trimethyl-N-(4-methylsulfonyl-2-nitro-phenyl)pyrazol-4-amine

Systemtic Name: 1,3,5-trimethyl-N-(4-methylsulfonyl-2-nitro-phenyl)pyrazol-4-amine Openeye Name: 1,3,5-trimethyl-N-(4-methylsulfonyl-2-nitro-phenyl)pyrazol-4-amine CAS Name: 1,3,5-trimethyl-N-(4-methylsulfonyl-2-nitrophenyl)-4-pyrazolamine IUPAC Name: 1,3,5-trimethyl-N-(4-methylsulfonyl-2-nitrophenyl)pyrazol-4-amine Traditional Name: (4-mesyl-2-nitro-phenyl)-(1,3,5-trimethylpyrazol-4-yl)amine Formula: C13H16N4O4S MolecularWeight: 324.35554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4S/c1-8-13(9(2)16(3)15-8)14-11-6-5-10(22(4,20)21)7-12(11)17(18)19/h5-7,14H,1-4H3