5-[(1-cyano-3-oxidanylidene-2-phenyl-pyrazol-4-yl)diazenyl]-2-methoxy-benzenesulfonyl chloride

Systemtic Name: 5-[(1-cyano-3-oxidanylidene-2-phenyl-pyrazol-4-yl)diazenyl]-2-methoxy-benzenesulfonyl chloride Openeye Name: 5-(1-cyano-3-oxo-2-phenyl-pyrazol-4-yl)azo-2-methoxy-benzenesulfonyl chloride CAS Name: 5-[(1-cyano-3-oxo-2-phenyl-4-pyrazolyl)azo]-2-methoxybenzenesulfonyl chloride IUPAC Name: 5-[(1-cyano-3-oxo-2-phenylpyrazol-4-yl)diazenyl]-2-methoxybenzenesulfonyl chloride Traditional Name: 5-[(1-cyano-3-keto-2-phenyl-3-pyrazolin-4-yl)azo]-2-methoxy-benzenesulfonyl chloride Formula: C17H12ClN5O4S MolecularWeight: 417.82628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N=NC2=CN(N(C2=O)C3=CC=CC=C3)C#N)S(=O)(=O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N=NC2=CN(N(C2=O)C3=CC=CC=C3)C#N)S(=O)(=O)Cl

InChI

InChI=1S/C17H12ClN5O4S/c1-27-15-8-7-12(9-16(15)28(18,25)26)20-21-14-10-22(11-19)23(17(14)24)13-5-3-2-4-6-13/h2-10H,1H3