4-(5-cyanothiophen-2-yl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide

Systemtic Name: 4-(5-cyanothiophen-2-yl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide Openeye Name: 4-[(5-cyano-2-thienyl)sulfanyl]-N-(2-methylquinuclidin-3-yl)benzamide CAS Name: 4-[(5-cyano-2-thiophenyl)thio]-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide IUPAC Name: 4-(5-cyanothiophen-2-yl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide Traditional Name: 4-[(5-cyano-2-thienyl)thio]-N-(2-methylquinuclidin-3-yl)benzamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC=C(S4)C#N

Isomeric SMILES

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC=C(S4)C#N

InChI

InChI=1S/C20H21N3OS2/c1-13-19(14-8-10-23(13)11-9-14)22-20(24)15-2-4-16(5-3-15)25-18-7-6-17(12-21)26-18/h2-7,13-14,19H,8-11H2,1H3,(H,22,24)