3-[3-fluoranyl-1-[4-(2-methylsulfonylphenyl)phenyl]-2-oxidanylidene-piperidin-3-yl]-5-pyridin-2-yl-thiophene-2-sulfonamide

Systemtic Name: 3-[3-fluoranyl-1-[4-(2-methylsulfonylphenyl)phenyl]-2-oxidanylidene-piperidin-3-yl]-5-pyridin-2-yl-thiophene-2-sulfonamide Openeye Name: 3-[3-fluoro-1-[4-(2-methylsulfonylphenyl)phenyl]-2-oxo-3-piperidyl]-5-(2-pyridyl)thiophene-2-sulfonamide CAS Name: 3-[3-fluoro-1-[4-(2-methylsulfonylphenyl)phenyl]-2-oxo-3-piperidinyl]-5-(2-pyridinyl)-2-thiophenesulfonamide IUPAC Name: 3-[3-fluoro-1-[4-(2-methylsulfonylphenyl)phenyl]-2-oxopiperidin-3-yl]-5-pyridin-2-ylthiophene-2-sulfonamide Traditional Name: 3-[3-fluoro-2-keto-1-[4-(2-mesylphenyl)phenyl]-3-piperidyl]-5-(2-pyridyl)thiophene-2-sulfonamide Formula: C27H24FN3O5S3 MolecularWeight: 585.689963

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)N3CCCC(C3=O)(C4=C(SC(=C4)C5=CC=CC=N5)S(=O)(=O)N)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)N3CCCC(C3=O)(C4=C(SC(=C4)C5=CC=CC=N5)S(=O)(=O)N)F

InChI

InChI=1S/C27H24FN3O5S3/c1-38(33,34)24-9-3-2-7-20(24)18-10-12-19(13-11-18)31-16-6-14-27(28,26(31)32)21-17-23(22-8-4-5-15-30-22)37-25(21)39(29,35)36/h2-5,7-13,15,17H,6,14,16H2,1H3,(H2,29,35,36)