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

Systemtic Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(4-nitrophenyl)-1,3-thiazole-2-carboxamide Openeye Name: N-(2-methylquinuclidin-3-yl)-5-(4-nitrophenyl)thiazole-2-carboxamide CAS Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(4-nitrophenyl)-2-thiazolecarboxamide IUPAC Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(4-nitrophenyl)-1,3-thiazole-2-carboxamide Traditional Name: N-(2-methylquinuclidin-3-yl)-5-(4-nitrophenyl)thiazole-2-carboxamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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