5-(3-bromanyl-4-methoxy-phenyl)-3-cyano-2-pyrazol-1-yl-benzenesulfonamide

Systemtic Name: 5-(3-bromanyl-4-methoxy-phenyl)-3-cyano-2-pyrazol-1-yl-benzenesulfonamide Openeye Name: 5-(3-bromo-4-methoxy-phenyl)-3-cyano-2-pyrazol-1-yl-benzenesulfonamide CAS Name: 5-(3-bromo-4-methoxyphenyl)-3-cyano-2-(1-pyrazolyl)benzenesulfonamide IUPAC Name: 5-(3-bromo-4-methoxyphenyl)-3-cyano-2-pyrazol-1-ylbenzenesulfonamide Traditional Name: 5-(3-bromo-4-methoxy-phenyl)-3-cyano-2-pyrazol-1-yl-benzenesulfonamide Formula: C17H13BrN4O3S MolecularWeight: 433.27912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C(C(=C2)C#N)N3C=CC=N3)S(=O)(=O)N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C(C(=C2)C#N)N3C=CC=N3)S(=O)(=O)N)Br

InChI

InChI=1S/C17H13BrN4O3S/c1-25-15-4-3-11(8-14(15)18)12-7-13(10-19)17(22-6-2-5-21-22)16(9-12)26(20,23)24/h2-9H,1H3,(H2,20,23,24)