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

Systemtic Name: [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-phenylazanyl-2-pyridin-2-yl-3-sulfanylidene-propanoate Openeye Name: [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-anilino-2-(2-pyridyl)-3-thioxo-propanoate CAS Name: 3-anilino-2-(2-pyridinyl)-3-sulfanylidenepropanoic acid [(2Z)-3,7-dimethylocta-2,6-dienyl] ester IUPAC Name: [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-anilino-2-pyridin-2-yl-3-sulfanylidenepropanoate Traditional Name: 3-anilino-2-(2-pyridyl)-3-thioxo-propionic acid [(2Z)-3,7-dimethylocta-2,6-dienyl] ester Formula: C24H28N2O2S MolecularWeight: 408.55632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCOC(=O)C(C1=CC=CC=N1)C(=S)NC2=CC=CC=C2)C)C

Isomeric SMILES

CC(=CCC/C(=C\COC(=O)C(C1=CC=CC=N1)C(=S)NC2=CC=CC=C2)/C)C

InChI

InChI=1S/C24H28N2O2S/c1-18(2)10-9-11-19(3)15-17-28-24(27)22(21-14-7-8-16-25-21)23(29)26-20-12-5-4-6-13-20/h4-8,10,12-16,22H,9,11,17H2,1-3H3,(H,26,29)/b19-15-