N-pyridin-1-ium-3-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-pyridin-1-ium-3-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-pyridin-1-ium-3-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(3-pyridin-1-iumyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-pyridin-1-ium-3-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-pyridin-1-ium-3-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C14H15N2OS+ MolecularWeight: 259.3467

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NC3=C[NH+]=CC=C3

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NC3=C[NH+]=CC=C3

InChI

InChI=1S/C14H14N2OS/c17-14(16-10-4-3-7-15-8-10)12-9-18-13-6-2-1-5-11(12)13/h3-4,7-9H,1-2,5-6H2,(H,16,17)/p+1