6-fluoranyl-9-[(E)-3-[4-(2-hydroxyethyl)piperidin-1-yl]prop-1-enyl]-N,N-dimethyl-9H-thioxanthene-2-sulfonamide

Systemtic Name: 6-fluoranyl-9-[(E)-3-[4-(2-hydroxyethyl)piperidin-1-yl]prop-1-enyl]-N,N-dimethyl-9H-thioxanthene-2-sulfonamide Openeye Name: 6-fluoro-9-[(E)-3-[4-(2-hydroxyethyl)-1-piperidyl]prop-1-enyl]-N,N-dimethyl-9H-thioxanthene-2-sulfonamide CAS Name: 6-fluoro-9-[(E)-3-[4-(2-hydroxyethyl)-1-piperidinyl]prop-1-enyl]-N,N-dimethyl-9H-thioxanthene-2-sulfonamide IUPAC Name: 6-fluoro-9-[(E)-3-[4-(2-hydroxyethyl)piperidin-1-yl]prop-1-enyl]-N,N-dimethyl-9H-thioxanthene-2-sulfonamide Traditional Name: 6-fluoro-9-[(E)-3-[4-(2-hydroxyethyl)piperidino]prop-1-enyl]-N,N-dimethyl-9H-thioxanthene-2-sulfonamide Formula: C25H31FN2O3S2 MolecularWeight: 490.653643

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)SC3=C(C2C=CCN4CCC(CC4)CCO)C=CC(=C3)F

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)SC3=C(C2/C=C/CN4CCC(CC4)CCO)C=CC(=C3)F

InChI

InChI=1S/C25H31FN2O3S2/c1-27(2)33(30,31)20-6-8-24-23(17-20)21(22-7-5-19(26)16-25(22)32-24)4-3-12-28-13-9-18(10-14-28)11-15-29/h3-8,16-18,21,29H,9-15H2,1-2H3/b4-3+