3-methylbutyl 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate

Systemtic Name: 3-methylbutyl 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate Openeye Name: isopentyl 3-(methylamino)-2-(2-pyridyl)-3-thioxo-propanoate CAS Name: 3-(methylamino)-2-(2-pyridinyl)-3-sulfanylidenepropanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidenepropanoate Traditional Name: 3-(methylamino)-2-(2-pyridyl)-3-thioxo-propionic acid isoamyl ester Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O2S/c1-10(2)7-9-18-14(17)12(13(19)15-3)11-6-4-5-8-16-11/h4-6,8,10,12H,7,9H2,1-3H3,(H,15,19)