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

Systemtic Name: 3-chloranyl-4-methyl-N-(1-methyl-3-oxidanylidene-2-phenyl-5-propan-2-yl-pyrazol-4-yl)-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-(5-isopropyl-1-methyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-4-methyl-N-(1-methyl-3-oxo-2-phenyl-5-propan-2-yl-4-pyrazolyl)-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-4-methyl-N-(1-methyl-3-oxo-2-phenyl-5-propan-2-ylpyrazol-4-yl)-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-(5-isopropyl-3-keto-1-methyl-2-phenyl-3-pyrazolin-4-yl)-4-methyl-5-nitro-benzenesulfonamide Formula: C20H21ClN4O5S MolecularWeight: 464.92254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O5S/c1-12(2)19-18(20(26)24(23(19)4)14-8-6-5-7-9-14)22-31(29,30)15-10-16(21)13(3)17(11-15)25(27)28/h5-12,22H,1-4H3