4-methyl-N-(1-methyl-3-oxidanylidene-2-phenyl-5-propan-2-yl-pyrazol-4-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-(1-methyl-3-oxidanylidene-2-phenyl-5-propan-2-yl-pyrazol-4-yl)-3-nitro-benzenesulfonamide Openeye Name: N-(5-isopropyl-1-methyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-(1-methyl-3-oxo-2-phenyl-5-propan-2-yl-4-pyrazolyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-(1-methyl-3-oxo-2-phenyl-5-propan-2-ylpyrazol-4-yl)-3-nitrobenzenesulfonamide Traditional Name: N-(5-isopropyl-3-keto-1-methyl-2-phenyl-3-pyrazolin-4-yl)-4-methyl-3-nitro-benzenesulfonamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5S/c1-13(2)19-18(20(25)23(22(19)4)15-8-6-5-7-9-15)21-30(28,29)16-11-10-14(3)17(12-16)24(26)27/h5-13,21H,1-4H3