N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-fluoro-N-[(3S)-quinuclidin-3-yl]benzothiophene-2-carboxamide CAS Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-fluoro-N-[(3S)-quinuclidin-3-yl]benzothiophene-2-carboxamide Formula: C16H16ClFN2OS MolecularWeight: 338.827443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

C1CN2CCC1[C@@H](C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C16H16ClFN2OS/c17-14-11-2-1-10(18)7-13(11)22-15(14)16(21)19-12-8-20-5-3-9(12)4-6-20/h1-2,7,9,12H,3-6,8H2,(H,19,21)/t12-/m1/s1