5-(4-acetamidophenyl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-1,3-thiazole-2-carboxamide

Systemtic Name: 5-(4-acetamidophenyl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-1,3-thiazole-2-carboxamide Openeye Name: 5-(4-acetamidophenyl)sulfanyl-N-(2-methylquinuclidin-3-yl)thiazole-2-carboxamide CAS Name: 5-[(4-acetamidophenyl)thio]-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-2-thiazolecarboxamide IUPAC Name: 5-(4-acetamidophenyl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-1,3-thiazole-2-carboxamide Traditional Name: 5-[(4-acetamidophenyl)thio]-N-(2-methylquinuclidin-3-yl)thiazole-2-carboxamide Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=NC=C(S3)SC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1C(C2CCN1CC2)NC(=O)C3=NC=C(S3)SC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C20H24N4O2S2/c1-12-18(14-7-9-24(12)10-8-14)23-19(26)20-21-11-17(28-20)27-16-5-3-15(4-6-16)22-13(2)25/h3-6,11-12,14,18H,7-10H2,1-2H3,(H,22,25)(H,23,26)