N-(1-azabicyclo[2.2.2]octan-3-yl)-7-(4-morpholin-4-ylcarbonylphenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-(4-morpholin-4-ylcarbonylphenyl)-1-benzothiophene-2-carboxamide Openeye Name: 7-[4-(morpholine-4-carbonyl)phenyl]-N-quinuclidin-3-yl-benzothiophene-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-[4-[4-morpholinyl(oxo)methyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-[4-(morpholine-4-carbonyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 7-[4-(morpholine-4-carbonyl)phenyl]-N-quinuclidin-3-yl-benzothiophene-2-carboxamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC4=C(S3)C(=CC=C4)C5=CC=C(C=C5)C(=O)N6CCOCC6

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC4=C(S3)C(=CC=C4)C5=CC=C(C=C5)C(=O)N6CCOCC6

InChI

InChI=1S/C27H29N3O3S/c31-26(28-23-17-29-10-8-19(23)9-11-29)24-16-21-2-1-3-22(25(21)34-24)18-4-6-20(7-5-18)27(32)30-12-14-33-15-13-30/h1-7,16,19,23H,8-15,17H2,(H,28,31)