N-(3-fluoranyl-5-pyridin-3-yl-phenyl)-4-methoxy-3-(4-methylpiperazin-1-yl)benzenesulfonamide

Systemtic Name: N-(3-fluoranyl-5-pyridin-3-yl-phenyl)-4-methoxy-3-(4-methylpiperazin-1-yl)benzenesulfonamide Openeye Name: N-[3-fluoro-5-(3-pyridyl)phenyl]-4-methoxy-3-(4-methylpiperazin-1-yl)benzenesulfonamide CAS Name: N-[3-fluoro-5-(3-pyridinyl)phenyl]-4-methoxy-3-(4-methyl-1-piperazinyl)benzenesulfonamide IUPAC Name: N-(3-fluoro-5-pyridin-3-ylphenyl)-4-methoxy-3-(4-methylpiperazin-1-yl)benzenesulfonamide Traditional Name: N-[3-fluoro-5-(3-pyridyl)phenyl]-4-methoxy-3-(4-methylpiperazino)benzenesulfonamide Formula: C23H25FN4O3S MolecularWeight: 456.533003

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)NC3=CC(=CC(=C3)C4=CN=CC=C4)F)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)NC3=CC(=CC(=C3)C4=CN=CC=C4)F)OC

InChI

InChI=1S/C23H25FN4O3S/c1-27-8-10-28(11-9-27)22-15-21(5-6-23(22)31-2)32(29,30)26-20-13-18(12-19(24)14-20)17-4-3-7-25-16-17/h3-7,12-16,26H,8-11H2,1-2H3