N1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-N4,N4-diethyl-benzene-1,4-disulfonamide

Systemtic Name: N1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-N4,N4-diethyl-benzene-1,4-disulfonamide Openeye Name: N1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-N4,N4-diethyl-benzene-1,4-disulfonamide CAS Name: N1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-N4,N4-diethylbenzene-1,4-disulfonamide IUPAC Name: 1-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-N,4-N-diethylbenzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzene-1,4-disulfonamide Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H26N4O5S2/c1-5-24(6-2)32(29,30)19-14-12-18(13-15-19)31(27,28)22-20-16(3)23(4)25(21(20)26)17-10-8-7-9-11-17/h7-15,22H,5-6H2,1-4H3