[(2Z)-3,7-dimethylocta-2,6-dienyl] 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate

Systemtic Name: [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidene-propanoate Openeye Name: [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-(methylamino)-2-(2-pyridyl)-3-thioxo-propanoate CAS Name: 3-(methylamino)-2-(2-pyridinyl)-3-sulfanylidenepropanoic acid [(2Z)-3,7-dimethylocta-2,6-dienyl] ester IUPAC Name: [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-(methylamino)-2-pyridin-2-yl-3-sulfanylidenepropanoate Traditional Name: 3-(methylamino)-2-(2-pyridyl)-3-thioxo-propionic acid [(2Z)-3,7-dimethylocta-2,6-dienyl] ester Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=CCC/C(=C\COC(=O)C(C1=CC=CC=N1)C(=S)NC)/C)C

InChI

InChI=1S/C19H26N2O2S/c1-14(2)8-7-9-15(3)11-13-23-19(22)17(18(24)20-4)16-10-5-6-12-21-16/h5-6,8,10-12,17H,7,9,13H2,1-4H3,(H,20,24)/b15-11-