N-[5-ethyl-3-[(R)-piperidin-1-ium-1-yl(pyridin-4-yl)methyl]thiophen-2-yl]benzamide

Systemtic Name: N-[5-ethyl-3-[(R)-piperidin-1-ium-1-yl(pyridin-4-yl)methyl]thiophen-2-yl]benzamide Openeye Name: N-[5-ethyl-3-[(R)-piperidin-1-ium-1-yl(4-pyridyl)methyl]-2-thienyl]benzamide CAS Name: N-[5-ethyl-3-[(R)-1-piperidin-1-iumyl(pyridin-4-yl)methyl]-2-thiophenyl]benzamide IUPAC Name: N-[5-ethyl-3-[(R)-piperidin-1-ium-1-yl(pyridin-4-yl)methyl]thiophen-2-yl]benzamide Traditional Name: N-[5-ethyl-3-[(R)-piperidin-1-ium-1-yl(4-pyridyl)methyl]-2-thienyl]benzamide Formula: C24H28N3OS+ MolecularWeight: 406.56362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC=NC=C3)[NH+]4CCCCC4

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)[C@@H](C3=CC=NC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C24H27N3OS/c1-2-20-17-21(24(29-20)26-23(28)19-9-5-3-6-10-19)22(18-11-13-25-14-12-18)27-15-7-4-8-16-27/h3,5-6,9-14,17,22H,2,4,7-8,15-16H2,1H3,(H,26,28)/p+1/t22-/m1/s1