1-[2-ethyl-4-methyl-5-(1,3,5-trimethyl-6-sulfanylidene-pyridin-2-yl)pyrazol-3-yl]ethanone

Systemtic Name: 1-[2-ethyl-4-methyl-5-(1,3,5-trimethyl-6-sulfanylidene-pyridin-2-yl)pyrazol-3-yl]ethanone Openeye Name: 1-[2-ethyl-4-methyl-5-(1,3,5-trimethyl-6-thioxo-2-pyridyl)pyrazol-3-yl]ethanone CAS Name: 1-[2-ethyl-4-methyl-5-(1,3,5-trimethyl-6-sulfanylidene-2-pyridinyl)-3-pyrazolyl]ethanone IUPAC Name: 1-[2-ethyl-4-methyl-5-(1,3,5-trimethyl-6-sulfanylidenepyridin-2-yl)pyrazol-3-yl]ethanone Traditional Name: 1-[2-ethyl-4-methyl-5-(1,3,5-trimethyl-6-thioxo-2-pyridyl)pyrazol-3-yl]ethanone Formula: C16H21N3OS MolecularWeight: 303.42244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C2=C(C=C(C(=S)N2C)C)C)C)C(=O)C

Isomeric SMILES

CCN1C(=C(C(=N1)C2=C(C=C(C(=S)N2C)C)C)C)C(=O)C

InChI

InChI=1S/C16H21N3OS/c1-7-19-15(12(5)20)11(4)13(17-19)14-9(2)8-10(3)16(21)18(14)6/h8H,7H2,1-6H3