3-[(4-tert-butylphenyl)sulfonylamino]-N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)propanamide

Systemtic Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)propanamide Openeye Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(6-fluorothiochroman-4-yl)propanamide CAS Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)propanamide IUPAC Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)propanamide Traditional Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-(6-fluorothiochroman-4-yl)propionamide Formula: C22H27FN2O3S2 MolecularWeight: 450.589783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C22H27FN2O3S2/c1-22(2,3)15-4-7-17(8-5-15)30(27,28)24-12-10-21(26)25-19-11-13-29-20-9-6-16(23)14-18(19)20/h4-9,14,19,24H,10-13H2,1-3H3,(H,25,26)