5-[(3-isocyano-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]-2-(2-methoxyethoxy)benzenesulfonamide

Systemtic Name: 5-[(3-isocyano-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]-2-(2-methoxyethoxy)benzenesulfonamide Openeye Name: 5-[(3-isocyano-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-2-(2-methoxyethoxy)benzenesulfonamide CAS Name: 5-[(3-isocyano-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-2-(2-methoxyethoxy)benzenesulfonamide IUPAC Name: 5-[(3-isocyano-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]-2-(2-methoxyethoxy)benzenesulfonamide Traditional Name: 5-[(3-isocyano-5-keto-1-phenyl-2-pyrazolin-4-yl)azo]-2-(2-methoxyethoxy)benzenesulfonamide Formula: C19H18N6O5S MolecularWeight: 442.44842

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)N=NC2C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-])S(=O)(=O)N

Isomeric SMILES

COCCOC1=C(C=C(C=C1)N=NC2C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-])S(=O)(=O)N

InChI

InChI=1S/C19H18N6O5S/c1-21-18-17(19(26)25(24-18)14-6-4-3-5-7-14)23-22-13-8-9-15(30-11-10-29-2)16(12-13)31(20,27)28/h3-9,12,17H,10-11H2,2H3,(H2,20,27,28)