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

Systemtic Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(2-nitrophenyl)-1,3-thiazole-2-carboxamide Openeye Name: N-(2-methylquinuclidin-3-yl)-5-(2-nitrophenyl)thiazole-2-carboxamide CAS Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(2-nitrophenyl)-2-thiazolecarboxamide IUPAC Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(2-nitrophenyl)-1,3-thiazole-2-carboxamide Traditional Name: N-(2-methylquinuclidin-3-yl)-5-(2-nitrophenyl)thiazole-2-carboxamide Formula: C18H20N4O3S MolecularWeight: 372.4414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=NC=C(S3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1C(C2CCN1CC2)NC(=O)C3=NC=C(S3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3S/c1-11-16(12-6-8-21(11)9-7-12)20-17(23)18-19-10-15(26-18)13-4-2-3-5-14(13)22(24)25/h2-5,10-12,16H,6-9H2,1H3,(H,20,23)