4-[(2E)-2-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]hydrazino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylidene]hydrazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]hydrazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(N'E)-N'-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]hydrazino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C21H23ClN6O4S MolecularWeight: 490.96312

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NN=CC2=C(N(N=C2C)C3=CC=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N/N=C/C2=C(N(N=C2C)C3=CC=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN6O4S/c1-4-26(5-2)33(31,32)17-11-12-19(20(13-17)28(29)30)24-23-14-18-15(3)25-27(21(18)22)16-9-7-6-8-10-16/h6-14,24H,4-5H2,1-3H3/b23-14+