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

Systemtic Name: N-[5-ethyl-3-[(R)-morpholin-4-ium-4-yl(pyridin-2-yl)methyl]thiophen-2-yl]benzamide Openeye Name: N-[5-ethyl-3-[(R)-morpholin-4-ium-4-yl(2-pyridyl)methyl]-2-thienyl]benzamide CAS Name: N-[5-ethyl-3-[(R)-4-morpholin-4-iumyl(2-pyridinyl)methyl]-2-thiophenyl]benzamide IUPAC Name: N-[5-ethyl-3-[(R)-morpholin-4-ium-4-yl(pyridin-2-yl)methyl]thiophen-2-yl]benzamide Traditional Name: N-[5-ethyl-3-[(R)-morpholin-4-ium-4-yl(2-pyridyl)methyl]-2-thienyl]benzamide Formula: C23H26N3O2S+ MolecularWeight: 408.53644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=CC=CC=N3)[NH+]4CCOCC4

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)[C@H](C3=CC=CC=N3)[NH+]4CCOCC4

InChI

InChI=1S/C23H25N3O2S/c1-2-18-16-19(23(29-18)25-22(27)17-8-4-3-5-9-17)21(20-10-6-7-11-24-20)26-12-14-28-15-13-26/h3-11,16,21H,2,12-15H2,1H3,(H,25,27)/p+1/t21-/m1/s1