N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-4-(4-morpholin-4-ylthiophen-2-yl)sulfanyl-benzamide

Systemtic Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-4-(4-morpholin-4-ylthiophen-2-yl)sulfanyl-benzamide Openeye Name: N-(2-methylquinuclidin-3-yl)-4-[(4-morpholino-2-thienyl)sulfanyl]benzamide CAS Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-4-[[4-(4-morpholinyl)-2-thiophenyl]thio]benzamide IUPAC Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-4-(4-morpholin-4-ylthiophen-2-yl)sulfanylbenzamide Traditional Name: N-(2-methylquinuclidin-3-yl)-4-[(4-morpholino-2-thienyl)thio]benzamide Formula: C23H29N3O2S2 MolecularWeight: 443.62526

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC(=CS4)N5CCOCC5

Isomeric SMILES

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC(=CS4)N5CCOCC5

InChI

InChI=1S/C23H29N3O2S2/c1-16-22(17-6-8-25(16)9-7-17)24-23(27)18-2-4-20(5-3-18)30-21-14-19(15-29-21)26-10-12-28-13-11-26/h2-5,14-17,22H,6-13H2,1H3,(H,24,27)