4-bromanyl-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzenesulfonamide Openeye Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzenesulfonamide CAS Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]benzenesulfonamide IUPAC Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]benzenesulfonamide Traditional Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzenesulfonamide Formula: C24H21BrN4O4S MolecularWeight: 541.41694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=NNS(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2/C=N/NS(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H21BrN4O4S/c1-32-22-13-8-17(14-23(22)33-2)24-18(16-29(27-24)20-6-4-3-5-7-20)15-26-28-34(30,31)21-11-9-19(25)10-12-21/h3-16,28H,1-2H3/b26-15+