N-(6-ethyl-3-propanoyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-methyl-benzamide

Systemtic Name: N-(6-ethyl-3-propanoyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-methyl-benzamide Openeye Name: N-(6-ethyl-3-propanoyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-methyl-benzamide CAS Name: N-[6-ethyl-3-(1-oxopropyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl]-4-methylbenzamide IUPAC Name: N-(6-ethyl-3-propanoyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-methylbenzamide Traditional Name: N-(6-ethyl-3-propionyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-4-methyl-benzamide Formula: C20H25N2O2S+ MolecularWeight: 357.4897

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(SC2=C1CC[NH+](C2)CC)NC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)C1=C(SC2=C1CC[NH+](C2)CC)NC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H24N2O2S/c1-4-16(23)18-15-10-11-22(5-2)12-17(15)25-20(18)21-19(24)14-8-6-13(3)7-9-14/h6-9H,4-5,10-12H2,1-3H3,(H,21,24)/p+1