2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-oxidanylidene-ethanamide

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-oxidanylidene-ethanamide Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-2-oxo-acetamide CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-oxoacetamide IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-oxoacetamide Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-N-[2-(4-mesyl-2-nitro-anilino)ethyl]acetamide Formula: C22H23N5O6S MolecularWeight: 485.51292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O6S/c1-14-20(15(2)26(25-14)16-7-5-4-6-8-16)21(28)22(29)24-12-11-23-18-10-9-17(34(3,32)33)13-19(18)27(30)31/h4-10,13,23H,11-12H2,1-3H3,(H,24,29)