N-[5-(3-chloranyl-4-methoxy-phenyl)-3-cyano-pyrazol-1-yl]benzenesulfonamide

Systemtic Name: N-[5-(3-chloranyl-4-methoxy-phenyl)-3-cyano-pyrazol-1-yl]benzenesulfonamide Openeye Name: N-[5-(3-chloro-4-methoxy-phenyl)-3-cyano-pyrazol-1-yl]benzenesulfonamide CAS Name: N-[5-(3-chloro-4-methoxyphenyl)-3-cyano-1-pyrazolyl]benzenesulfonamide IUPAC Name: N-[5-(3-chloro-4-methoxyphenyl)-3-cyanopyrazol-1-yl]benzenesulfonamide Traditional Name: N-[5-(3-chloro-4-methoxy-phenyl)-3-cyano-pyrazol-1-yl]benzenesulfonamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C#N)Cl

InChI

InChI=1S/C17H13ClN4O3S/c1-25-17-8-7-12(9-15(17)18)16-10-13(11-19)20-22(16)21-26(23,24)14-5-3-2-4-6-14/h2-10,21H,1H3