S-tert-butyl 2-pyridin-2-ylethanethioate

Systemtic Name: S-tert-butyl 2-pyridin-2-ylethanethioate Openeye Name: S-tert-butyl 2-(2-pyridyl)ethanethioate CAS Name: 2-(2-pyridinyl)ethanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-pyridin-2-ylethanethioate Traditional Name: 2-(2-pyridyl)ethanethioic acid S-tert-butyl ester Formula: C11H15NOS MolecularWeight: 209.3079

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)CC1=CC=CC=N1

Isomeric SMILES

CC(C)(C)SC(=O)CC1=CC=CC=N1

InChI

InChI=1S/C11H15NOS/c1-11(2,3)14-10(13)8-9-6-4-5-7-12-9/h4-7H,8H2,1-3H3