S-pyridin-1-ium-4-yl ethanethioate

Systemtic Name: S-pyridin-1-ium-4-yl ethanethioate Openeye Name: S-pyridin-1-ium-4-yl ethanethioate CAS Name: ethanethioic acid S-(4-pyridin-1-iumyl) ester IUPAC Name: S-pyridin-1-ium-4-yl ethanethioate Traditional Name: ethanethioic acid S-pyridin-1-ium-4-yl ester Formula: C7H8NOS+ MolecularWeight: 154.20952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=CC=[NH+]C=C1

Isomeric SMILES

CC(=O)SC1=CC=[NH+]C=C1

InChI

InChI=1S/C7H7NOS/c1-6(9)10-7-2-4-8-5-3-7/h2-5H,1H3/p+1