N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-fluoro-benzenesulfonamide CAS Name: N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-fluorobenzenesulfonamide IUPAC Name: N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-fluoro-benzenesulfonamide Formula: C19H21FN2O2S2 MolecularWeight: 392.510643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)[C@@H]1CCC2=C(C1)SC(=C2C#N)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H21FN2O2S2/c1-19(2,3)12-4-9-15-16(11-21)18(25-17(15)10-12)22-26(23,24)14-7-5-13(20)6-8-14/h5-8,12,22H,4,9-10H2,1-3H3/t12-/m1/s1