1,4-diazabicyclo[3.2.2]nonan-4-yl-(5-pyridin-4-ylthiophen-3-yl)methanone

Systemtic Name: 1,4-diazabicyclo[3.2.2]nonan-4-yl-(5-pyridin-4-ylthiophen-3-yl)methanone Openeye Name: 1,4-diazabicyclo[3.2.2]nonan-4-yl-[5-(4-pyridyl)-3-thienyl]methanone CAS Name: 1,4-diazabicyclo[3.2.2]nonan-4-yl-(5-pyridin-4-yl-3-thiophenyl)methanone IUPAC Name: 1,4-diazabicyclo[3.2.2]nonan-4-yl-(5-pyridin-4-ylthiophen-3-yl)methanone Traditional Name: 1,4-diazabicyclo[3.2.2]nonan-4-yl-[5-(4-pyridyl)-3-thienyl]methanone Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1N(CC2)C(=O)C3=CSC(=C3)C4=CC=NC=C4

Isomeric SMILES

C1CN2CCC1N(CC2)C(=O)C3=CSC(=C3)C4=CC=NC=C4

InChI

InChI=1S/C17H19N3OS/c21-17(20-10-9-19-7-3-15(20)4-8-19)14-11-16(22-12-14)13-1-5-18-6-2-13/h1-2,5-6,11-12,15H,3-4,7-10H2