N-(5-ethyl-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-5-ium-2-yl)-3-pentoxy-benzamide

Systemtic Name: N-(5-ethyl-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-5-ium-2-yl)-3-pentoxy-benzamide Openeye Name: N-(5-ethyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-5-ium-2-yl)-3-pentoxy-benzamide CAS Name: N-(5-ethyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-5-ium-2-yl)-3-pentoxybenzamide IUPAC Name: N-(5-ethyl-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-5-ium-2-yl)-3-pentoxybenzamide Traditional Name: 3-amoxy-N-(5-ethyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-5-ium-2-yl)benzamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C[NH+](CC3)CC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C[NH+](CC3)CC

InChI

InChI=1S/C20H27N3O2S/c1-3-5-6-12-25-16-9-7-8-15(13-16)19(24)22-20-21-17-10-11-23(4-2)14-18(17)26-20/h7-9,13H,3-6,10-12,14H2,1-2H3,(H,21,22,24)/p+1