6-chloranyl-5-fluoranyl-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 6-chloranyl-5-fluoranyl-N-[(3S)-2-oxidanylidene-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]-1-benzothiophene-2-sulfonamide Openeye Name: 6-chloro-5-fluoro-N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-oxo-3-piperidyl]benzothiophene-2-sulfonamide CAS Name: 6-chloro-5-fluoro-N-[(3S)-2-oxo-1-(1-propan-2-yl-4-piperidinyl)-3-piperidinyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 6-chloro-5-fluoro-N-[(3S)-2-oxo-1-(1-propan-2-ylpiperidin-4-yl)piperidin-3-yl]-1-benzothiophene-2-sulfonamide Traditional Name: 6-chloro-5-fluoro-N-[(3S)-1-(1-isopropyl-4-piperidyl)-2-keto-3-piperidyl]benzothiophene-2-sulfonamide Formula: C21H27ClFN3O3S2 MolecularWeight: 488.038783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)N2CCCC(C2=O)NS(=O)(=O)C3=CC4=CC(=C(C=C4S3)Cl)F

Isomeric SMILES

CC(C)N1CCC(CC1)N2CCC[C@@H](C2=O)NS(=O)(=O)C3=CC4=CC(=C(C=C4S3)Cl)F

InChI

InChI=1S/C21H27ClFN3O3S2/c1-13(2)25-8-5-15(6-9-25)26-7-3-4-18(21(26)27)24-31(28,29)20-11-14-10-17(23)16(22)12-19(14)30-20/h10-13,15,18,24H,3-9H2,1-2H3/t18-/m0/s1