4-tert-butyl-2-pyridin-3-yl-2H-thiophen-5-one

Systemtic Name: 4-tert-butyl-2-pyridin-3-yl-2H-thiophen-5-one Openeye Name: 4-tert-butyl-2-(3-pyridyl)-2H-thiophen-5-one CAS Name: 4-tert-butyl-2-(3-pyridinyl)-2H-thiophen-5-one IUPAC Name: 4-tert-butyl-2-pyridin-3-yl-2H-thiophen-5-one Traditional Name: 4-tert-butyl-2-(3-pyridyl)-2H-thiophen-5-one Formula: C13H15NOS MolecularWeight: 233.3293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(SC1=O)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(SC1=O)C2=CN=CC=C2

InChI

InChI=1S/C13H15NOS/c1-13(2,3)10-7-11(16-12(10)15)9-5-4-6-14-8-9/h4-8,11H,1-3H3