4-[1-(2-dimethylaminoethyl)-4-(3-fluoranyl-4-methoxy-phenyl)pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[1-(2-dimethylaminoethyl)-4-(3-fluoranyl-4-methoxy-phenyl)pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[1-(2-dimethylaminoethyl)-4-(3-fluoro-4-methoxy-phenyl)pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[1-(2-dimethylaminoethyl)-4-(3-fluoro-4-methoxyphenyl)-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[1-(2-dimethylaminoethyl)-4-(3-fluoro-4-methoxyphenyl)pyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[1-(2-dimethylaminoethyl)-4-(3-fluoro-4-methoxy-phenyl)pyrazol-3-yl]benzenesulfonamide Formula: C20H23FN4O3S MolecularWeight: 418.485023

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CN(C)CCN1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H23FN4O3S/c1-24(2)10-11-25-13-17(15-6-9-19(28-3)18(21)12-15)20(23-25)14-4-7-16(8-5-14)29(22,26)27/h4-9,12-13H,10-11H2,1-3H3,(H2,22,26,27)