tert-butyl 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate

Systemtic Name: tert-butyl 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate Openeye Name: tert-butyl 3-(methylamino)-2-(2-pyridyl)-3-thioxo-propanoate CAS Name: 3-(methylamino)-2-(2-pyridinyl)-3-sulfanylidenepropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidenepropanoate Traditional Name: 3-(methylamino)-2-(2-pyridyl)-3-thioxo-propionic acid tert-butyl ester Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC=CC=N1)C(=S)NC

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=CC=CC=N1)C(=S)NC

InChI

InChI=1S/C13H18N2O2S/c1-13(2,3)17-12(16)10(11(18)14-4)9-7-5-6-8-15-9/h5-8,10H,1-4H3,(H,14,18)